Model name: model_name=MEAM_LAMMPS_SaLee_2008_NbFe__MO_162036141261_001
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.611098557710648
cohesive_energy=4.242432871320217
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.27478640671954e-19, 3.00839104389546e-19, 3.5595558277577994e-19, 4.00787689348368e-19, 4.3864872538642205e-19, 4.71302687363976e-19, 4.998310445089799e-19, 5.249499697768319e-19, 5.4717215969041195e-19, 5.668757279353439e-19, 5.84355475012284e-19, 5.9983891000326e-19, 6.14719926579852e-19, 6.282999757296359e-19, 6.38938428579396e-19, 6.48099674572608e-19, 6.55937522666136e-19, 6.62535286044948e-19, 6.679682670108419e-19, 6.7229734827591e-19, 6.75583412552244e-19, 6.778745251388639e-19, 6.792203535114239e-19, 6.796593499091399e-19, 6.79183503448842e-19, 6.77642209526934e-19, 6.748335938875319e-19, 6.7051893221217e-19, 6.64411434883362e-19, 6.561618273948959e-19, 6.45350339468664e-19, 6.3146427458178595e-19, 6.1386917078719795e-19, 5.91789574594044e-19, 5.6425456696212e-19, 5.300545045327559e-19, 4.8765450209058e-19, 4.35106312848648e-19, 3.6989451949157997e-19, 2.88750681686016e-19, 1.87369750816398e-19, 5.99994321136758e-20, -1.011524604816096e-19, -3.06834449353974e-19, -5.72154899944374e-19, -9.18846697422366e-19, -1.378943761408146e-18, -2.00115065939868e-18, -2.86219242604296e-18, -4.08814594284708e-18, -5.897387885025239e-18, -8.6938910690742e-18, -1.3291320898570858e-17, -2.1528447431057998e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.0185525854032881
Energy: 0.024035997606457308
Energy: 0.1114018484410827
Energy: 0.11071959336776202
Energy: 0.02317654514969428
Energy: 0.019906051884723136
Energy: 0.10787898693673907
Energy: 0.11202484873224856
Energy: 0.11003669623709922
Energy: 0.022538658978032526
Energy: 0.030029502018098255
Energy: 0.1160838185589078
Energy: 0.11037176895317238
Energy: 0.11328512805894528
Energy: 0.1117923598211303
Energy: 0.10906309967947929
Energy: 0.11557428061748168
Energy: 0.1080502623775626
Energy: 0.11238304863141892
Energy: 0.11090251950413943
Energy: 0.11096188664762793
Energy: 0.02538167508177169
Energy: 0.01903863990906857
Energy: 0.10889273055467069
Energy: 0.10990370695426559
Energy: 0.11019077805036794
Energy: 0.024318588077395502
Energy: 0.018987192418341854
Energy: 0.10880680382213603
Energy: 0.11133853847569615
Energy: 0.1118548350519788
Energy: 0.02035356368736596
Energy: 0.019999039009417893
Energy: 0.11416810548127491
Energy: 0.1093930044371504
Energy: 0.11075375414962661
Energy: 0.02011185958703218
Energy: 0.0194686196548995
Energy: 0.11235832891695482
Energy: 0.10928290825201542
Energy: 0.11112338704443962
Energy: 0.10969387905950347
Energy: 0.11227529161043566
Energy: 0.026275092821096104
Energy: 0.01987873433525107
Energy: 0.1104258302097532
Energy: 0.11019951314743506
Energy: 0.11170821817692166
Energy: 0.02511271394356007
Energy: 0.11452977186631015
Energy: 0.1116344908756338
Energy: 0.10866971180980031
Energy: 0.10988962839919533
Energy: 0.019508577495843244
Energy: 0.027854928589587918
Energy: 0.11311060282875726
Energy: 0.10802812990897341
Energy: 0.11026989072178925
Energy: 0.020083789534540587
Energy: 0.01964751588568743
Energy: 0.028488977922308707
Energy: 0.1127466794343111
Energy: 0.11153772202837851
Energy: 0.10859614907575253
Energy: 0.11402027300763104
Energy: 0.02689800213341917
Energy: 0.11405775648531204
Energy: 0.11113534893245995
Energy: 0.10927502643966368
Energy: 0.11310057730371907

minimum gb energy = 0.0185525854032881 eV
minimum distance =  2.51019737599152 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

Energy: -0.8054509013906905
Energy: 0.6803137997931765
Energy: -0.026811963740202813
Energy: -0.35284559943114213
Energy: -0.3161563752791168
Energy: -0.24515596077207685
Energy: -0.3537050073685432
Energy: -0.08250731464206006
Energy: -0.30508404264951977
Energy: 0.6155220375398256
Energy: 0.7147618843018206
Energy: 0.9391668132843298
Energy: -0.08343984384302218
Energy: -0.34971378410647946
Energy: -0.4655211445930817
Energy: 0.10097551565143094
Energy: -0.3383495862419634
Energy: -0.07435511260539486
Energy: -0.47572544710637993
Energy: 0.45637719857055026
Energy: 0.6783024203354956
Energy: 0.0486426810181839
Energy: 0.8173154466377288
Energy: -0.4098269287591372
Energy: -0.4047976468443867
Energy: -0.4096665542925121
Energy: 0.8363563695218889
Energy: 0.817715765556086
Energy: 0.5644502930633138
Energy: 0.671409286058914
Energy: -0.4017609018270983
Energy: -0.8838838212257063
Energy: 0.8976708438163576
Energy: 0.5636549959993776
Energy: -0.411386113362254
Energy: -0.3987089267285294
Energy: -0.46462707572197565
Energy: 0.898187158704468
Energy: -0.5090543187273182
Energy: -0.4129449243090117
Energy: 0.4429586979553414
Energy: 0.8685596577748527
Energy: 0.693785884593673
Energy: 0.8225447284495275
Energy: 0.2956518983832996
Energy: 0.8324002757932507
Energy: 0.7862164790473597
Energy: -1.2528760703244302
Energy: -0.2643600001710181
Energy: 0.6390773765836573
Energy: -0.8032288249714928
Energy: 0.7705911906640456
Energy: 0.691783281645038
Energy: 0.6101092101712885
Energy: -0.5640040616441041
Energy: 0.6487325694794335
Energy: 0.7095681632132222
Energy: 0.6532728343164781
Energy: 0.5442353171171069
Energy: 0.7676211202984684
Energy: -0.2030110588276029
Energy: 0.9344585925705131
Energy: -1.036113995858962
Energy: 0.6203860493645557
Energy: 0.8262492223398842
Energy: 0.40481131506034146
Energy: 0.9443854650350955
Energy: 0.6119186627887644
Energy: 0.6062617607127533
Energy: 0.7008557017790519
Energy: 0.5971670141083398
Energy: 0.6633220164121248
Energy: -0.4895581789035576
Energy: 0.6916439328817472
Energy: -0.18699390462532378
Energy: 0.33344828439379726
Energy: 0.685857527106747
Energy: -0.018776748400434536
Energy: 0.6064558343149069
Energy: 0.689234053748294
Energy: 0.2831533511857923
Energy: 0.7319063670836131
Energy: 0.4863073935100807
Energy: 0.9765908978810892
Energy: 0.6712676584998497
Energy: -0.3293842291366189
Energy: 0.6147047690827803
Energy: 0.5375658564637104
Energy: 0.9567281823326987
Energy: 0.6606710992663642
Energy: 0.8436513424150038
Energy: 0.5724629921318959
Energy: 0.5541570942646449
Energy: -0.7245262461332744
Energy: 0.8622636960401148
Energy: -0.08674908473935253
Energy: 0.40211261100071666
Energy: 0.6093837810643986
Energy: 0.6142347060915121
Energy: 0.5770340717049809
Energy: 0.6994301743574532
Energy: 0.5797013222889427
Energy: 0.629912082929377
Energy: 0.24236834601895285
Energy: 0.6650205329991573
Energy: 0.5743859166152966
Energy: 0.5672398587389695
Energy: 0.7003823124801674
Energy: 0.6636338927821833
Energy: 0.5780800881509724
Energy: 0.9299360635204138
Energy: 0.71376027027543
Energy: 0.7071043980226326
Energy: 0.8154946414772386
Energy: 0.8232888484628345
Energy: 0.9259951195390503
Energy: 0.4895752716095512
Energy: 0.781265302749517
Energy: 0.8407094386833087
Energy: 0.8297491466633445
Energy: 0.7737488507106266
Energy: 0.9093994347846509
Energy: 0.8068852750379559
Energy: 0.6955942427872754
Energy: 0.6986912698927127
Energy: 0.9037121863183175
Energy: 0.9213091667692411
Energy: 0.7941989170584439
Energy: 0.6969427884653278
Energy: 0.6973677457469268
Energy: -0.38947003923989987
Energy: 0.7497309718522521
Energy: 0.6611316099276788
Energy: 0.6316774155723474
Energy: 0.47084505719085756
Energy: 0.4858374454295129
Energy: 0.7403328827955052
Energy: 0.6851093792449972
Energy: 0.7920475587257974
Energy: 0.8463928461240882
Energy: 0.677042293329723
Energy: 0.7320647400984825
Energy: 0.8189177225472246
Energy: 0.6305655240529897
Energy: 0.68461181662585
Energy: 0.6741838049910506
Energy: -0.35832729096746563
Energy: 0.8099885057851444
Energy: 0.7684906493766941
Energy: 0.6832039508557624
Energy: 0.6311303751491196
Energy: 0.898732555981711
Energy: 0.6231345773115362
Energy: 0.6839014179745923
Energy: 0.736496102408286
Energy: 0.5936992224420735
Energy: -1.5297670292512136
Energy: 0.809613527267312
Energy: 0.6842876905351761
Energy: 0.6747275558385373
Energy: 0.6757982221572927
Energy: -0.18297917668604743
Energy: 0.5746079565012904
Energy: 0.7047922283019223
Energy: 0.7366517818227208
Energy: 0.5591738859991551
Energy: 0.8774289169402539
Energy: 0.8114511646570896
Energy: 0.7159533613655852
Energy: 0.7473691566326781
Energy: 0.7133323232781148
Energy: -1.0476121500792088
Energy: 0.8967070337026881
Energy: 0.7462368926342539
Energy: 0.5249267998366426
Energy: 0.7475833666863128
Energy: 0.5773566853485756
Energy: 0.8972443316022042
Energy: 0.7226023028453833
Energy: 0.5708959655618603
Energy: 0.8244952536728042
Energy: 1.0182898724302862
Energy: -0.8121561534800512
Energy: 0.05109802370520201
Energy: 0.6211789284567698
Energy: 0.8625433690467366
Energy: 0.17695154061373747
Energy: -0.24865631652421724
Energy: 0.7056951823772359
Energy: -0.08498488438710876
Energy: -0.21658326120763846
Energy: -0.7828643529965507
Energy: 0.7347019300917635
Energy: 0.5450873091656409
Energy: 0.6409669424881744
Energy: 0.6979191566954552
Energy: -0.17980369464639875
Energy: 0.7668178886233691
Energy: 0.25478508027718905
Energy: 0.6379326172159788
Energy: 0.920649828248991
Energy: 0.9263248338316086
Energy: 0.7207442912371044
Energy: 0.5372583300634791
Energy: 0.799543927757747
Energy: 0.31512383583028075
Energy: 0.8567711121744228
Energy: 0.6833130647237883
Energy: 0.6167659437359483
Energy: 0.8144603968338654
Energy: 0.5374384540913018
Energy: 0.6656412314617576
Energy: 0.9218461251110243
Energy: 0.6550799042384812
Energy: 0.669053481284532
Energy: 0.751818111646927
Energy: 0.6654705804742148
Energy: 0.9192659264545925
Energy: 0.8303258077615941
Energy: 0.708186862844631
Energy: 0.972380940921501
Energy: 0.6803830662928678
Energy: 0.5351568453548889
Energy: 0.906738455499236
Energy: 0.662279715064566
Energy: 0.9794946671506038
Energy: 0.7192182470252508
Energy: 0.6021797441632025
Energy: 1.0009287818749943
Energy: 0.6807783126755449
Energy: 0.7026575379301329
Energy: 0.12523294784760353
Energy: 0.5424203833214737
Energy: 0.6821478318807249
Energy: 0.5776525337785079
Energy: -0.8449879799392883
Energy: 0.6248886052569506
Energy: 0.48543877421492304
Energy: 0.04299329046253637
Energy: 0.5774999556919441
Energy: -0.015693521106575337
Energy: 0.48227792639253986
Energy: 0.5751295876444122
Energy: -0.6313342031455422
Energy: 0.5798244366830436
Energy: 0.6709547991222002
Energy: 0.560166182570393
Energy: 0.5591116673771188
Energy: -0.5197654007031173
Energy: 0.5782697346975156
Energy: -0.9883778601580024
Energy: 0.588964932548598
Energy: 0.614120185800059
Energy: 0.9081804833614259
Energy: 0.6212063155277754
Energy: -0.9891858347038466
Energy: -0.31306457815940664
Energy: 0.8204108070723268
Energy: 0.8469616389066038
Energy: 0.005406104167514862
Energy: -0.10872358606785658
Energy: 0.24400866783158243
Energy: 0.6396916881766815
Energy: -0.1972446401508832
Energy: 0.6980213680042169
Energy: -0.9890958778095487
Energy: -0.9896944117206748
Energy: -0.090508277099821
Energy: -0.782172020278855
Energy: -0.20869585677211772
Energy: 0.6959684713633983
Energy: 0.7748608031363976
Energy: -0.3556512405284435
Energy: -0.7684048879000085
Energy: -0.4369101361767167
Energy: -0.3089767561771342
Energy: -0.4095619873051634
Energy: -0.07648722337582951
Energy: 0.8035190474326883
Energy: 0.8152923901909835
Energy: 0.7532377050328524
Energy: -0.31523866196465056
Energy: -0.34684820509957737
Energy: -0.30238275181325025
Energy: -0.6459354968950681
Energy: -0.3733945881376633
Energy: -0.35317206174726207
Energy: -0.00920922157010803
Energy: -0.29782118701113924
Energy: -0.42345012347725425

minimum gb energy = -1.5297670292512136 eV
minimum distance =  2.39751159691874 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 2.296229573602401
Energy: 0.8838371122124443
Energy: 0.8549468181760898
Energy: 0.8580315276724962
Energy: 0.8874039248352066
Energy: 0.8366745209009995
Energy: 0.8814989107158336
Energy: 0.761023919994893
Energy: 0.855552055579617
Energy: 0.8777390841504304
Energy: 0.8423642319400798
Energy: 0.9018804017706137
Energy: 0.7605017311611393
Energy: 0.8584711080992201
Energy: 0.8270183125803142
Energy: 0.7848667331014948
Energy: 0.965804644878596
Energy: 0.06031374061574011
Energy: 0.8306876320333381
Energy: 0.8067940035691095
Energy: 0.8660518052987202
Energy: 0.9263167150728734
Energy: 0.9128242551265903
Energy: 0.8095632921493269
Energy: 0.852269704924612
Energy: 0.717787802870891
Energy: 0.9249253917231995
Energy: 0.916889561048699
Energy: 0.8439645406139412
Energy: 0.8436115038428524
Energy: 0.7924887097687011
Energy: 0.8217977622123048
Energy: 0.9924924825195273
Energy: 0.7382766139821778
Energy: 0.815576756286235
Energy: 0.8348806413582363
Energy: 0.8188898789936369
Energy: 0.8073819648552851
Energy: 0.8698292279644863
Energy: 0.8571075516475911
Energy: 0.9317466847974705
Energy: 0.8430660646345918
Energy: 0.9069406396092351
Energy: 1.0049754916166014
Energy: 0.8794586588600762
Energy: 0.8990850579153392
Energy: 0.8350456392510276
Energy: 0.8597995316297179
Energy: 0.931373843805545
Energy: 0.8913356216361981
Energy: 0.9029626069839068
Energy: 0.8936288010448629
Energy: 0.8947382709997658
Energy: 0.8526487880681406
Energy: 0.9176292953255282
Energy: 0.8917986337668806
Energy: 0.9225030567745549
Energy: 0.8737174365840079
Energy: 0.8115432173262919
Energy: 0.891161576682628
Energy: 0.8498562159438515
Energy: 0.8106079692595474
Energy: 0.9253532431003995
Energy: 0.8255037527864307
Energy: 0.8305743656795564
Energy: 0.8442366705162931
Energy: 0.8218495424790055
Energy: 0.9077075920075048
Energy: 0.8412467585064829
Energy: 0.8146564737662535
Energy: 0.8567550707311519
Energy: 0.8510533868592481
Energy: 0.9232076283813743
Energy: 0.9116179179725312
Energy: 0.8838772527313488
Energy: 0.8366164674945074
Energy: 0.8329278645206706
Energy: 0.922476491629669
Energy: 0.9098066966749023
Energy: 0.8838957828093574
Energy: 0.8472094378686358
Energy: 0.8998559961926756
Energy: 0.7829311857618674
Energy: 0.972219668788087
Energy: 0.874172934044046
Energy: 0.852842094732474
Energy: 0.6863778590442178
Energy: 0.8498399641879671
Energy: 0.9945016891433591
Energy: 0.8130906487169317
Energy: 0.9546515750954921
Energy: 0.9447032006342527
Energy: 0.7546717707875827
Energy: 0.983270330594348
Energy: 1.0185004921787673
Energy: 0.9346999315445275
Energy: 0.9416512841962357
Energy: 0.8155026902792728
Energy: 0.968034258025595
Energy: 1.0253930541041676
Energy: 0.9198611433060789
Energy: 0.8653455578756042
Energy: 0.9299583885282149
Energy: 0.9982199929959858
Energy: 0.9958477624195152
Energy: 0.9541837375764115
Energy: 0.883916424770077
Energy: 0.9255842732442361
Energy: 1.0045821905641887
Energy: 1.0174259057682278
Energy: 0.8762990893494055
Energy: 0.8226756667046433
Energy: 0.9193421710665033
Energy: 0.9422556562876557
Energy: 0.968929509006555
Energy: 0.8701986887071509
Energy: 0.8436089343864299
Energy: 0.9876691439765554
Energy: 0.9692775481077905
Energy: 0.9190870263087968
Energy: 0.8481925633985701
Energy: 0.8163062205221352
Energy: 0.9045125485025164
Energy: 0.9136273053920556
Energy: 0.7695001614654023
Energy: 0.812513072985283
Energy: 0.8204590890782335
Energy: 0.8722762111490954
Energy: 0.9133840350481589
Energy: 0.7728773564191433
Energy: 0.9167985695531037
Energy: 0.8490116071502306
Energy: 1.0201940535397813
Energy: 0.8436727609738673
Energy: 0.9872241627064431
Energy: 0.8009889957366175
Energy: 0.7681760892544662
Energy: 0.986073765803045
Energy: 0.7806354980112717
Energy: 0.9612473896995399
Energy: 0.9585131667020252
Energy: 0.9001965777716968
Energy: 0.9528540202473703
Energy: 0.918713303159351
Energy: 0.9136963198303533
Energy: 0.9806103280426479
Energy: 0.9019315088763222
Energy: 0.9041605394524449
Energy: 0.916685688363657
Energy: 0.9135336451289806
Energy: 0.9683027555373258
Energy: 0.8678096101512394
Energy: 0.7534188720925716
Energy: 0.9312634638740019
Energy: 0.9076297029357349
Energy: 0.9818773080642403
Energy: 0.9194707076162659
Energy: 0.7751622261567641
Energy: 0.9235925420887795
Energy: 0.8180583504632513
Energy: 0.9717730658478662
Energy: 0.8473870615229542
Energy: 0.8711434120985719
Energy: 0.8260784198832128
Energy: 0.9653393540507883
Energy: 1.017561494384586
Energy: 0.7903417689255398
Energy: 0.8090686206121706
Energy: 0.6882272212154812
Energy: 0.8439734444751887
Energy: 0.48166735694826435
Energy: 0.8182227805392068
Energy: 0.8229423453252735
Energy: 0.8458401184235729
Energy: 0.8906638896557421
Energy: 0.41612030302991304
Energy: 0.8401642178599372
Energy: 0.8218959685535272
Energy: 0.791602467065339
Energy: 0.9623789447157836
Energy: 0.9623000953186253
Energy: 0.8302678478967754
Energy: 0.8594592813845972
Energy: 0.9548272752632326
Energy: 0.7640720905752666
Energy: 0.9535565179651808
Energy: 0.7884681831104944
Energy: 0.8637302147721595
Energy: 0.9489268975400336
Energy: 0.828966962768602
Energy: 0.893163716461552
Energy: 0.9390342110129039
Energy: 0.8877967604341056
Energy: 0.9244042610480818
Energy: 0.8938580421435959
Energy: 0.8957149552423402
Energy: 0.9346195321821255
Energy: 0.9063434898156704
Energy: 0.9006483638229776
Energy: 0.9117185744214458
Energy: 0.7826926546110848
Energy: 0.948497182262065
Energy: 0.9225502446380416
Energy: 0.7898081133380785
Energy: 0.905531469932257
Energy: 0.8156705297984221
Energy: 0.9248000983482846
Energy: 0.911832796112242
Energy: 0.737831690500912
Energy: 0.8892666585051202
Energy: 0.9591157450775166
Energy: 0.8567775367019916
Energy: 0.8171542405262892
Energy: 0.7631203145045998
Energy: 0.8962541822280735
Energy: 0.8586842047145264
Energy: 0.8767959725306643
Energy: 0.8027780411181924
Energy: 0.7829761566261252
Energy: 0.9054285870703719
Energy: 0.9777649514469029
Energy: 0.8087834839711717
Energy: 0.8094402610010302
Energy: 0.8183983502931428
Energy: 0.876795508070909
Energy: 0.9496470967110205
Energy: 0.8124215366735732
Energy: 0.8232198430980473
Energy: 0.8098596435760386
Energy: 0.8478628494175663
Energy: 0.8624881032430951
Energy: 0.9365548775113464
Energy: 0.8790310393345263
Energy: 0.9188793988218759
Energy: 0.9279203941793294
Energy: 0.9494167024833424
Energy: 0.9523950403786832
Energy: 0.805497091024883
Energy: 0.9593977326304018
Energy: 0.9169300849515346
Energy: 0.9024628323378573
Energy: 0.9211823428785747
Energy: 0.9307532519080138
Energy: 0.9336092785818816
Energy: 0.9255729885652596
Energy: 0.9090184087685959
Energy: 0.9518716215109109
Energy: 0.9775275764030984
Energy: 0.8197068569111247
Energy: 0.9379433470229585
Energy: 1.025956095029272
Energy: 0.8409704874257754
Energy: 1.0008170419890865
Energy: 0.8495437042250299
Energy: 0.4529120565341675
Energy: 0.9920546281455148
Energy: 0.8134093604631989
Energy: 0.9796014566708423
Energy: 0.8294056137652891
Energy: 0.8823279356775213
Energy: 0.8448028255325097
Energy: 0.7955476536379767
Energy: 0.8094317457647849
Energy: 0.8553219380612667
Energy: 0.8337935738691457
Energy: 0.8981757679718086
Energy: 0.9131833919338909
Energy: 0.854824412030175
Energy: 0.8673239232176772
Energy: 0.8524056759847549
Energy: 1.0135229812487543
Energy: 0.8975659414106563
Energy: 0.8612735822652361
Energy: 0.8202284572080201
Energy: 0.8728442444263577
Energy: 0.9421584397779504
Energy: 0.9605077003269804
Energy: 0.832775700370643
Energy: 0.8164774967768685
Energy: 0.8537696623073828
Energy: 0.9984895643095405
Energy: 0.9578274368911603
Energy: 0.9410473594872064
Energy: 0.8241410288096254
Energy: 0.9381879900177562
Energy: 0.922740687043245
Energy: 0.9606947504814487
Energy: 0.9700375677561793
Energy: 0.8262491336021621
Energy: 0.9249367119352659
Energy: 0.8903675514823118
Energy: 0.8919222380679985
Energy: 0.8854443267223863
Energy: 0.911663203015284
Energy: 0.9264485860528858
Energy: 0.8824668797857514
Energy: 0.9044424693510016
Energy: 0.8235330782743098
Energy: 0.916175994039226
Energy: 0.8897958509411792
Energy: 0.8489495158331202
Energy: 0.9267410443194504
Energy: 0.8075393608458271
Energy: 0.9229596512936761
Energy: 0.8790755988017698
Energy: 0.8082659572563116
Energy: 0.9280859029664336
Energy: 0.8433195745222999
Energy: 0.9133244480516687
Energy: 0.8779738193760186
Energy: 0.8588851846601465
Energy: 0.9264828439409457
Energy: 0.9118196938321901
Energy: 0.30193571515742024
Energy: 0.8488306106833593
Energy: 0.9000189211230049
Energy: 0.925169453760802
Energy: 0.9129246136761756
Energy: 0.8374930410845663
Energy: 0.8683954239434472
Energy: 0.8524773744993297
Energy: 0.8254482967097321
Energy: 0.9665237454132737
Energy: 0.8864496518205308
Energy: 0.8566736689471914
Energy: 0.8719027014648006
Energy: 0.832681000740307
Energy: 0.9048021777092481
Energy: 0.9124216999366722
Energy: 0.8575110295567567
Energy: 0.9319591114179789
Energy: 0.7999562965782709
Energy: 0.9693943683571438
Energy: 0.9880176110789802
Energy: 0.9204148951053971
Energy: 1.006257113151704
Energy: 0.7957767417992143
Energy: 0.9222728891135089
Energy: 0.9905875028594985
Energy: 0.9249469235562499
Energy: 0.9077427674141001
Energy: 0.9287137749964083
Energy: 0.9309582041391098
Energy: 0.8772806840672814
Energy: 0.9520738612505409
Energy: 0.8771482194432597
Energy: 0.9561834887524044
Energy: 0.9111996606914095
Energy: 0.8325574719128875
Energy: 0.9242049622451427
Energy: 0.8621001789533329
Energy: 0.8689100638570382
Energy: 0.9087638217855609
Energy: 0.9103822573721758
Energy: 0.8618169491036317
Energy: 0.8415597304137591
Energy: 0.8847150356049246
Energy: 0.9662680827384891
Energy: 0.8932859696428663
Energy: 0.8612762868595856
Energy: 0.8580130809482714
Energy: 0.8395822001982427
Energy: 0.9228267732711768
Energy: 0.9126609193218929
Energy: 0.8461879072404457
Energy: 0.814450814039806
Energy: 0.8697064685118651
Energy: 0.9225052887260597
Energy: 0.9109529653125713
Energy: 0.8253544955942805
Energy: 0.8472228124396042
Energy: 0.8313074870028967
Energy: 0.8034717379866159
Energy: 0.9314322846965479
Energy: 0.8807375130272295
Energy: 0.852407402268316
Energy: 0.844837322345512
Energy: 0.8000752754384521
Energy: 0.9024375736716547
Energy: 0.8753260151958903
Energy: 0.8876806954354749
Energy: 0.937704958649674
Energy: 0.8081657385593314
Energy: 0.9232623695711254
Energy: 0.9273790671005874
Energy: 0.8887384272553897
Energy: 0.9088062685237287
Energy: 0.7740934832067359
Energy: 0.9104369284650452
Energy: 0.9450868822719569
Energy: 0.8897629797684711
Energy: 0.911543576066151
Energy: 0.9310319562342206
Energy: 0.904048212425454
Energy: 0.9660646979378775
Energy: 0.8861285343462115
Energy: 0.8803584570907466
Energy: 0.9004057129992799
Energy: 0.897726603656414
Energy: 0.9428363072548611
Energy: 0.8677332118217526
Energy: 0.8038918087016828
Energy: 0.8545636453084597
Energy: 0.9008697385403795
Energy: 0.9547225703750295
Energy: 0.8557859727175117
Energy: 0.8016781501229914
Energy: 0.8839003246043043
Energy: 0.9600743620567703
Energy: 0.9187684846747284
Energy: 0.5361078154572377
Energy: 0.8154907803400857
Energy: 0.8090172072795457
Energy: 0.9134750080522036
Energy: 0.7986200907354098
Energy: 0.8530839060863177
Energy: 0.8201735498026216
Energy: 0.8147636950353885
Energy: 0.9132264756275599
Energy: 0.8103670514390146
Energy: 0.8356444295396346
Energy: 0.7001323748334489
Energy: 0.8676323771475949
Energy: 0.5457483117366999
Energy: 0.9066465324558521
Energy: 0.8189646166123205
Energy: 0.8672304202589428
Energy: 0.9553663287359766
Energy: 0.8384401536535082
Energy: 0.9484614169523706
Energy: 0.97671688207729
Energy: 0.9162984891093489
Energy: 0.9150759112196819
Energy: 0.933638670407492
Energy: 0.9358012802121155
Energy: 0.9592024826596964
Energy: 0.889276281441443
Energy: 0.9411733622841685
Energy: 0.9088802457284083
Energy: 0.9274660006246265
Energy: 0.9590506864977579
Energy: 0.9121616579866322
Energy: 0.8152248695947857
Energy: 0.9298126639102651
Energy: 0.9475303795993384
Energy: 0.9407363625169218
Energy: 0.9221057835244977
Energy: 0.8358791926478805
Energy: 0.885156013918291
Energy: 0.8144089416535055
Energy: 1.0299667665801322
Energy: 0.8818222501248987
Energy: 0.7777286340156283
Energy: 0.8969314018725076
Energy: 0.9598041816149341
Energy: 0.9145137693051292
Energy: 0.8742029380282604
Energy: 0.8402435747798324
Energy: 1.0113238737900239
Energy: 0.8500927936156095
Energy: 0.8555458469108456
Energy: 0.8172016561547608
Energy: 0.8222691476048128
Energy: 0.8265625719819583
Energy: 0.9685337798302746
Energy: 0.8418971052426883
Energy: 0.8400476197176907
Energy: 0.809675847423559
Energy: 0.8755946183536484
Energy: 0.9623527930261352
Energy: 0.95289710444571
Energy: 0.8344662488491464
Energy: 0.8695598807881486
Energy: 1.0174831469935413
Energy: 0.8133455172214061
Energy: 0.9802571036043356
Energy: 0.8747567177227342
Energy: 0.881682806341025
Energy: 1.0068818016954257
Energy: 0.8473432215505531
Energy: 0.9196653350795789
Energy: 1.0229027686978183
Energy: 0.9334380507308692
Energy: 0.9202872050292399
Energy: 0.8736574213885653
Energy: 0.9424262522025488
Energy: 1.0128038602470344
Energy: 0.9241344972986041
Energy: 0.9263804644038157
Energy: 0.8669078407582352
Energy: 0.862860308271578
Energy: 1.0265640206289224
Energy: 0.9254902984682758
Energy: 0.7920022497950792
Energy: 0.9950591870789586
Energy: 0.8297814590278659
Energy: 1.023616181618507
Energy: 0.9540114043870525
Energy: 0.7933695678230624
Energy: 0.9539110432673956
Energy: 0.9620993388577489
Energy: 0.8566397836683689
Energy: 0.890606979072882
Energy: 0.893604963800161
Energy: 0.9175182791460177
Energy: 0.8592373282986767
Energy: 0.8908229610219423
Energy: 0.8703803576018552
Energy: 0.8529701176462183
Energy: 0.940941931947411
Energy: 0.9787349134546068
Energy: 0.8856162296675716
Energy: 0.8237195084411191
Energy: 0.8408950820447324
Energy: 0.8906085269709305
Energy: 0.8983214831089623
Energy: 0.9024509704247774
Energy: 0.8181336266241837
Energy: 0.8231763850300996
Energy: 0.8446028077916578
Energy: 0.8503910585592359
Energy: 0.89596272994482
Energy: 0.8044563640499373
Energy: 0.9466151194923694
Energy: 0.8903142092454304
Energy: 0.9658521640064418
Energy: 0.9244515364061963
Energy: 0.8749640854861451
Energy: 0.9337414273684894
Energy: 0.9871992028217594
Energy: 0.9040221380990523
Energy: 0.893284972378702
Energy: 0.953173457238849
Energy: 0.8851058432096949
Energy: 0.9111773545446441
Energy: 0.8891535452038652
Energy: 0.9143115458218095
Energy: 0.9335473794518688
Energy: 0.9282715266951928
Energy: 0.8631359722825734
Energy: 0.9389291345783539
Energy: 0.805161677605874
Energy: 0.9073293023482544
Energy: 0.7557505986449328
Energy: 0.822996852308633
Energy: 0.8865042568342087
Energy: 0.8427844588727658
Energy: 0.9153819324080782
Energy: 0.8635295174235248
Energy: 0.8081173201416669
Energy: 0.7744572238664863
Energy: 0.7643917209721233
Energy: 0.8049085532258949
Energy: 0.7007616429754232
Energy: 0.8171043840220023
Energy: 0.7635173226179388
Energy: 0.912640026692932
Energy: 0.7416057061874023
Energy: 0.847922965335608
Energy: 0.855226957027167
Energy: 1.006668384948109
Energy: 0.8978576154791241
Energy: 0.8096432646095386
Energy: 0.8209920658363411
Energy: 0.58806855680007
Energy: 0.8667891570880717
Energy: 0.9405549056196023
Energy: 0.7952457038448875
Energy: 0.8168037638323526
Energy: 0.8686631676540894
Energy: 0.9366726205005673
Energy: 0.9263212154136085
Energy: -0.2127796984412632
Energy: 0.7347290756720258
Energy: 0.9015099121061858
Energy: 0.8597641945932709
Energy: 0.9361341660873074
Energy: 0.8909872005681767
Energy: 0.7380960061099612
Energy: 1.0261848074533588

minimum gb energy = -0.2127796984412632 eV
minimum distance =  2.23971358737366 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

Energy: 2.1224858636883885
Energy: 0.7625152924545856
Energy: 0.6810043824700985
Energy: 0.6801320133173688
Energy: 0.7999625518649476
Energy: 0.8692559175945826
Energy: 0.6676440855077213
Energy: 0.679207549456293
Energy: 0.6784357242540014
Energy: 0.8445280554226171
Energy: 0.8777691879498518
Energy: 0.8855927084364641
Energy: 0.6818184306441897
Energy: 0.68061932467236
Energy: 0.9033657094381328
Energy: 0.5972577160461504
Energy: 0.8047063556616774
Energy: 0.6806376308343692
Energy: 0.6848538534910124
Energy: 0.9211025873937994
Energy: 0.9040779781915468
Energy: 0.9010305298723905
Energy: 0.8671364772615845
Energy: 0.8978368361441823
Energy: 0.9075849843887198
Energy: 0.8639064142626267
Energy: 0.909512226886737
Energy: 0.8670350363919133
Energy: 0.9089326807611183
Energy: 0.9113699963557886
Energy: 0.8640371448021313
Energy: 0.6855014560117194
Energy: 0.925347409519129
Energy: 0.8836093770382112
Energy: 0.8842959279570651
Energy: 0.855949635368986
Energy: 0.6675344998482607
Energy: 0.8570268417486904
Energy: 0.8874362884152253
Energy: 0.8902770999235984
Energy: 0.8957708202101639
Energy: 0.8919183199961113
Energy: 0.9134020968925275
Energy: 0.8977547254773223
Energy: 0.8643748360176449
Energy: 0.884604723639918
Energy: 0.9208667116361007
Energy: 0.8093925452389896
Energy: 0.8982761711538185
Energy: 0.8970564737616415
Energy: 0.8758316999135237
Energy: 0.8794954805909654
Energy: 0.922247164444821
Energy: 0.8972117669519045
Energy: 0.9004348121359432
Energy: 0.8956864666648835
Energy: 0.766406430178699
Energy: 0.9327768957240641
Energy: 0.8963073696239454
Energy: 0.9194820043138776
Energy: 0.8965951947111541
Energy: 0.9555453231147174
Energy: 0.9213880556801644
Energy: 0.8998759637666057
Energy: 0.8960595540817271
Energy: 0.7471273246113858
Energy: 0.8853981287820452
Energy: 0.9214366070991025
Energy: 0.9003408258197897
Energy: 0.898319447697586
Energy: 0.9130387736391575
Energy: 0.8727590468393449
Energy: 0.9320644185773433
Energy: 0.9326007001157676
Energy: 0.9650821587744959
Energy: 0.9588034480681008
Energy: 0.8654950131663071
Energy: 0.9363733296886876
Energy: 0.9145277107314534
Energy: 0.9815974014929574
Energy: 0.8736675675441291
Energy: 0.9645890748999484
Energy: 0.6715119198688185
Energy: 0.9211458986779352
Energy: 0.9500616624504192
Energy: 0.8913403986130214
Energy: 0.9285703952913666
Energy: 0.7814375281424991
Energy: 0.9164778046708587
Energy: 0.9449468719838762
Energy: 0.8091233509065819
Energy: 0.8977385386001101
Energy: 0.8587674889617763
Energy: 0.850454055827585
Energy: 0.8159160467671517
Energy: 0.6770544117124955
Energy: 0.9258492604291141
Energy: 0.8450244055115159
Energy: 0.8623512304908842
Energy: 0.9291062538167454
Energy: 0.8301571342828487
Energy: 0.8956127941223313
Energy: 0.8880778567962888
Energy: 0.8025557961350206
Energy: 0.6359285802395032
Energy: 0.8029198805794249
Energy: 0.8749809275183916
Energy: 0.9061255942482951
Energy: 0.8416347404565331
Energy: 0.6362239059976331
Energy: 0.8396807672383954
Energy: 0.9643538806858019
Energy: 0.9068351872980825
Energy: 0.8745810719089754
Energy: 0.6738250295118728
Energy: 0.8253834436434989
Energy: 0.7848782150918614
Energy: 0.8770654838062004
Energy: 0.8728190717216483
Energy: 0.38436889192704193
Energy: 0.8217715817673815
Energy: 0.15153458668786035
Energy: 0.8903247825557706
Energy: 0.87881590389004
Energy: 0.9023199984076974
Energy: 0.8838401425945273
Energy: 0.8742733109598287
Energy: 0.880755497107694
Energy: 0.8850072418000913
Energy: 0.9016013000299824
Energy: 0.893319380352595
Energy: 0.8306417493526489
Energy: 0.4524774624749365
Energy: 0.8750978013401337
Energy: 0.8838883060200807
Energy: 0.9112984023929098
Energy: 0.8511718551929384
Energy: 0.7678352398081432
Energy: 0.8732030944177778
Energy: 0.8819300320819292
Energy: 0.8581414726694528
Energy: 0.8679157132503917
Energy: 0.9236109292237449
Energy: 0.9222388258451145
Energy: 0.8258979858636978
Energy: 0.8270964803463908
Energy: 0.8349775511439951
Energy: 0.9104431543724861
Energy: 0.8763336943123639
Energy: 0.8359867740609359
Energy: 0.8540896455566312
Energy: 0.8349828790873706
Energy: 0.8077923593008738
Energy: 0.9241854091483188
Energy: 0.880311697091123
Energy: 0.8648212084063942
Energy: 0.8417768019717942
Energy: 0.7706130551761144
Energy: 0.7851793848573241
Energy: 0.8636475143732079
Energy: 0.6778497344739495
Energy: 0.8584417427939335
Energy: 0.8971181752637092
Energy: 0.800718292896477
Energy: 0.6900351871474031
Energy: 0.6776754216119258
Energy: 0.8726530544818337
Energy: 0.8848903830616871
Energy: 0.683996935160859
Energy: 0.685899607003365
Energy: 0.6769756386732166
Energy: 0.8987588265690147
Energy: 0.8732419334605531
Energy: 0.6780412944591124
Energy: 0.7155734839264585
Energy: 0.6758501149233351
Energy: 0.8714321891611981
Energy: 0.8689680068578456
Energy: 0.6794442463502663
Energy: 0.7043077224735026
Energy: 0.6781145605737562
Energy: 0.8694669754782343
Energy: 0.8857531008702972
Energy: 0.6776037402199901
Energy: 0.7044801172729689
Energy: 0.6795693495854316
Energy: 0.8666981523185902
Energy: 0.8604752194144496
Energy: 0.6789233602955093
Energy: 0.7916335713107834
Energy: 0.8972226039988839
Energy: 0.8971977029638283
Energy: 0.8726953900956952
Energy: 0.8872685749980586
Energy: 0.8967150067074493
Energy: 0.8892414408558154
Energy: 0.8664496535904866
Energy: 0.9108112203911967
Energy: 0.8873732944779069
Energy: 0.9141774607060835
Energy: 0.8701160284520627
Energy: 0.8564788471784266
Energy: 0.8878646415727245
Energy: 0.6742855443195691
Energy: 0.868451596054795
Energy: 0.8791024351327162
Energy: 0.8780791901621843
Energy: 0.904965375969984
Energy: 0.6753970925920492
Energy: 0.8271774068618046
Energy: 0.8985717801376474
Energy: 0.8875822604936668
Energy: 0.898931466822192
Energy: 0.6806516449843908
Energy: 0.9067500641919536
Energy: 0.8965670978051151
Energy: 0.842523963924105
Energy: 0.8750902353668121
Energy: 0.680156792507147
Energy: 0.8476766625983084
Energy: 0.8970237606159556
Energy: 0.9194366484859561
Energy: 0.8905335460159762
Energy: 0.8552902851869494
Energy: 0.893697635814587
Energy: 0.8980831152424491
Energy: 0.9041513384153865
Energy: 0.8902809540747045
Energy: 0.8529936278113186
Energy: 0.8905219479716984
Energy: 0.8962866324534853
Energy: 0.9068322138106191
Energy: 0.6807344861397192
Energy: 0.8809900737370747
Energy: 0.900552491315233
Energy: 0.8961874738138355
Energy: 0.9147696608457261
Energy: 0.6796062654525863
Energy: 0.8540944643255513
Energy: 0.92168272165275
Energy: 0.9160072839546961
Energy: 0.917180577725035
Energy: 0.7651163453758526
Energy: 0.8767518699093891
Energy: 0.6791027502514325
Energy: 0.9010962247029711
Energy: 0.9179322595136518
Energy: 0.7656818849989186
Energy: 0.9173325583372097
Energy: 0.6798863411964134
Energy: 0.9365115204028547
Energy: 0.8884821080742121
Energy: 0.880488121302659
Energy: 0.8371463553746828
Energy: 0.9267152633598758
Energy: 0.9327975912502346
Energy: 0.8661321156376734
Energy: 0.8981168256839099
Energy: 0.8878579639218794
Energy: 0.9395039615351601
Energy: 0.8357426654253346
Energy: 0.8327236174421306
Energy: 0.7635309489800376
Energy: 0.7468116505279078
Energy: 0.9593781328208161
Energy: 0.8299100818373433
Energy: 0.7084506594634544
Energy: 0.8618901771794357
Energy: 0.8955044494917834
Energy: 0.9827665180969871
Energy: 0.8321028086591046
Energy: 0.8595972762856635
Energy: 0.8297592236562495
Energy: 0.8735528527650799
Energy: 0.8560674237601658
Energy: 0.8264652675514866
Energy: 0.8123869141474224
Energy: 0.8148731542876145
Energy: -0.052182333823885936
Energy: 0.8576808715667021
Energy: 0.7983462288612508
Energy: 0.8448174327083184
Energy: 0.8824296507194918
Energy: 0.7805986815272546
Energy: 0.8964516065260297
Energy: 0.796329420997989
Energy: 0.8272374495818686
Energy: 0.9376253356467861
Energy: 0.7521909114099368
Energy: 0.888449555745178
Energy: 0.8636974771958305
Energy: 0.8888617237530703
Energy: 0.8947995392786106
Energy: 0.9114323018897081
Energy: 0.8808353910616935
Energy: 0.8611548279287521
Energy: 0.8552645635369832
Energy: 0.8941728016395929
Energy: 0.8820004787864891
Energy: 0.8900364523286775
Energy: 0.8746101876564158
Energy: 0.8865639066670739
Energy: 0.7558713161779576
Energy: 0.9091389411221179
Energy: 0.869479662981459
Energy: 0.872328322173025
Energy: 0.8810958552197203
Energy: 0.7539618065486048
Energy: 0.7792977805156975
Energy: 0.8653091747352842
Energy: 0.8985320346412078
Energy: 0.8263363585833693
Energy: 0.7835880699621981
Energy: 0.8164692779225726
Energy: 0.8894368131560835
Energy: 0.8894941094902309
Energy: 0.8584414254682774
Energy: 0.7824491275880607
Energy: 0.845373769949476
Energy: 0.8096272206599717
Energy: 0.8418796822553025
Energy: 0.8353149562331705
Energy: 0.8339617484329775
Energy: 0.844308913090164
Energy: 1.0181336776809664
Energy: 0.8663704714827385
Energy: 0.8346696825655903
Energy: 0.8335069748017891
Energy: 0.8831417201546755
Energy: 0.8952828561828057
Energy: 0.8262450878017219
Energy: 0.7087354728649928
Energy: 0.8241453499651435
Energy: 0.8489212717219257
Energy: 0.9525998502035262
Energy: 0.6767162311057073
Energy: 0.7380276576885993
Energy: 0.872936453904404
Energy: 0.8860722680403511
Energy: 0.9437813410925363
Energy: 0.6797743832350763
Energy: 0.7166522215447826
Energy: 0.6686057614651784
Energy: 0.8691994771320355
Energy: 0.9010644086217049
Energy: 0.680208173246849
Energy: 0.8156584654842971
Energy: 0.6672461141103998
Energy: 0.8883670452601576
Energy: 0.8884867691246552
Energy: 0.679350683697301
Energy: 0.7027966445135575
Energy: 0.676292113270108
Energy: 0.8957616177391122
Energy: 0.8250655384414897
Energy: 0.6803839648396831
Energy: 0.7056485605081397
Energy: 0.6762391679630435
Energy: 0.8915842564441093
Energy: 0.8703381351442692
Energy: 0.8875147114818565
Energy: 0.8867018250405483
Energy: 0.8892200589397137
Energy: 0.8666431526780605
Energy: 0.8576171439811213
Energy: 0.8926270297447139
Energy: 0.8905543651751923
Energy: 0.8994640321836599
Energy: 0.8843031840116545
Energy: 0.8737057306042632
Energy: 0.8878433076956155
Energy: 0.8767227633307502
Energy: 0.8740107636818555
Energy: 0.926782705736536
Energy: 0.8899913265938254
Energy: 0.8873817838792061
Energy: 0.8735391040191205
Energy: 0.8739767578780249
Energy: 0.8722352923857971
Energy: 0.9014128083209572
Energy: 0.8789873386975928
Energy: 0.8968782964460273
Energy: 0.8664654440105976
Energy: 0.9077664590985406
Energy: 0.7022992543954828
Energy: 0.827814768460725
Energy: 0.897144169129887
Energy: 0.8753952463729388
Energy: 0.8602567751987877
Energy: 0.7615780858150547
Energy: 0.8722715186176346
Energy: 0.8926391015684256
Energy: 0.8982373346682498
Energy: 0.9056728315983171
Energy: 0.874393871464653
Energy: 0.7434431103111658
Energy: 0.8893195323355957
Energy: 0.9209281942011571
Energy: 0.8811564763989681
Energy: 0.8788572803580684
Energy: 0.9000497553359353
Energy: 0.9050630250278391
Energy: 0.9021115757823784
Energy: 0.8930037364383854
Energy: 0.880805472963393
Energy: 0.9113398586774021
Energy: 0.9215438012310597
Energy: 0.8889460329259551
Energy: 0.9213903892485125
Energy: 0.9257363371928238
Energy: 0.9661829321726132
Energy: 0.9391986484189742
Energy: 0.9447039639063224
Energy: 0.910469848516915
Energy: 0.8240964580837318
Energy: 0.9382825476166207
Energy: 0.9124664647201355
Energy: 0.9259669418494888
Energy: 0.9746898798505554
Energy: 0.9448049835358
Energy: 0.8483995999041444
Energy: 0.9461510554338809
Energy: 0.9423534149341464
Energy: 0.8828360327005865
Energy: 0.8815723818664882
Energy: 0.7628681388992433
Energy: 0.9102244187143109
Energy: 0.9343709308357463
Energy: 0.869501172550154
Energy: 0.8821479161245129
Energy: 0.8841722566066048
Energy: 0.9764018228768836
Energy: 0.8284730747721113
Energy: 0.6712193686782613
Energy: 0.8761498727699849
Energy: 0.8847253309393508
Energy: 0.9330138259541846
Energy: 0.8468824158017368
Energy: 0.6800545698360386
Energy: 0.9140839736176933
Energy: 0.863620606794114
Energy: 0.8403785785854965
Energy: 0.8313989876782913
Energy: 0.8185871638430912
Energy: 0.8960722806445106
Energy: 0.8635744510634003
Energy: 0.818503213306273
Energy: 0.8352328089899089
Energy: 0.8396130873324412
Energy: 0.8962616291845812
Energy: 0.8945821177679505
Energy: 0.9200743258563485
Energy: 0.22117821608573907
Energy: 0.8302729073037693
Energy: 0.9284215436061879
Energy: 0.810612993995479
Energy: 0.8696532763231984
Energy: 0.7777468192393706
Energy: 0.8345924322084841
Energy: 0.9670338399240637
Energy: 0.9376028989559918
Energy: 0.9051961290618232
Energy: 0.9070988934261702
Energy: 0.8016356929524462
Energy: 0.8709964206344339
Energy: 0.8682139672064074
Energy: 0.9038402386438186
Energy: 0.8776956280477988
Energy: 0.8738298495606771
Energy: 1.0178572322403594
Energy: 0.8184735573552483
Energy: 0.8765918625629389
Energy: 0.876686320545829
Energy: 0.874185235105453
Energy: 0.8820449550624674
Energy: 0.8005792412315279
Energy: 0.8769141934920579
Energy: 0.8710611110681026
Energy: 0.8292447138802856
Energy: 0.8120765642093516
Energy: 0.824723440924018
Energy: 0.7741526275262877
Energy: 0.820560094345612
Energy: 0.8021202569144141
Energy: 0.773941042236094
Energy: 0.7956629354903243
Energy: 0.7772582307662637
Energy: 0.8645008063245789
Energy: 0.8944577593153001
Energy: 0.7667221478559003
Energy: 0.8869858006496089
Energy: 0.8865307475847232
Energy: 0.8503967450760112
Energy: 0.852504822561879
Energy: 0.8680461401510821
Energy: 0.8778597033700487
Energy: 0.8835974062393368
Energy: 0.8812380034657724
Energy: 0.8531083641816315
Energy: 0.8366966724457828
Energy: 0.8767625188902302
Energy: 0.8603192107467114
Energy: 0.6859942930272878
Energy: 0.6779114275433052
Energy: 0.7988012140097408
Energy: 0.869999579481104
Energy: 0.8928762773122423
Energy: 0.6820677511350219
Energy: 0.7798039539342119
Energy: 0.8575627996295466
Energy: 0.8860206728069189
Energy: 0.668448744538064
Energy: 0.6806388615132068
Energy: 0.6777248043548026
Energy: 0.6666132674705081
Energy: 0.9654537473186436
Energy: 0.6679331612280256
Energy: 0.6790930507304854
Energy: 0.6775866263414664
Energy: 0.8195448608948599

minimum gb energy = -0.052182333823885936 eV
minimum distance =  2.24701613779624 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 0.8845709956141161
Energy: 0.8364099668669178
Energy: 0.1917726782246183
Energy: 0.23640071223209877
Energy: 0.8057739888724598
Energy: 0.8584011111614288
Energy: 0.23666028449809615
Energy: 0.87595188176581
Energy: 0.2361901500681608
Energy: 0.8345774716360854
Energy: 0.8620377064162118
Energy: 0.9221284291844193
Energy: 0.8651976211390113
Energy: 0.15877040682518126
Energy: 0.23641797767486983
Energy: 0.8407793808403982
Energy: -0.02250433647852403
Energy: 0.23634168615460469
Energy: 0.4589233387055504
Energy: 0.26539405449078163
Energy: 0.9039413026041745
Energy: 0.9182511217674727
Energy: 0.8991406770405157
Energy: 0.8915041834063977
Energy: 0.862044211914821
Energy: 0.8993293222784732
Energy: 0.25131679219946435
Energy: 0.8866035104802381
Energy: 0.9010920647701564
Energy: 0.8617385235221384
Energy: 0.8666472791078762
Energy: 0.8673982103146562
Energy: 0.9283461704777255
Energy: 0.831157720490687
Energy: 0.8775968483043927
Energy: 0.2861075100447766
Energy: 0.23632232200121367
Energy: 0.24470140305351545
Energy: 0.8587427136642881
Energy: 0.8610957274559145
Energy: 0.8953354800662893
Energy: 0.8533769435034362
Energy: 0.9281578996869578
Energy: 0.9309576672531934
Energy: -0.4115724506051882
Energy: 0.8810578817868809
Energy: 0.8525036106784147
Energy: 0.8945792448216547
Energy: 0.9246849156362568
Energy: 0.8968408024704132
Energy: 0.8423770087055686
Energy: 0.867504031083825
Energy: 0.8930582083028463
Energy: 0.8478148912273276
Energy: 0.8529738409579457
Energy: 0.8426839575879502
Energy: 0.8662571876337348
Energy: 0.8510231505971945
Energy: 0.8462324998472365
Energy: 0.8991494013169592
Energy: 0.881219029788399
Energy: 0.8763529592871564
Energy: 0.8955102980984055
Energy: 0.8915210955900025
Energy: 0.91312706710715
Energy: -0.02266938497413776
Energy: 0.8958364602458204
Energy: 0.8778915728981546
Energy: 0.9101096736290758
Energy: 0.8722821300393235
Energy: 0.8489461504000897
Energy: 0.8874036889236607
Energy: 0.9333453138835284
Energy: 0.9327859070423449
Energy: 0.8830387601982577
Energy: 0.8068581340057772
Energy: 0.9219912511870176
Energy: 0.9323441562493914
Energy: 0.9400364416264441
Energy: 0.8054186492376405
Energy: 0.8069639305018516
Energy: 0.870462388877987
Energy: 0.9020339468112091
Energy: 0.904017876044554
Energy: 0.8906987509487982
Energy: 0.8273347760027793
Energy: 0.8851885482902008
Energy: 0.903414338214676
Energy: 0.9018506610389313
Energy: 0.8210961628879752
Energy: 0.9447626675375583
Energy: 0.8764370416379708
Energy: 0.9022193496634046
Energy: 0.8793768095725601
Energy: 0.9052339924641979
Energy: 0.9436338927831822
Energy: 0.902491919797542
Energy: 0.8898752969060271
Energy: 0.8923090920735456
Energy: 0.8643967762633669
Energy: 0.8384983526416433
Energy: 0.8837103311064057
Energy: 0.8701667852493615
Energy: 0.8770082136866353
Energy: 0.8605641351658391
Energy: 0.857279052230133
Energy: 0.8515028822869279
Energy: 0.902454203391926
Energy: 0.907543512913077
Energy: 0.8613911931716351
Energy: 0.8927064195695491
Energy: 0.8989482963429375
Energy: 0.9086181083859152
Energy: 0.9250477990440451
Energy: 0.8985643321988783
Energy: 0.8933309934111294
Energy: 0.8416136834156158
Energy: 0.9060904005893315
Energy: 0.9134949415768291
Energy: 0.9223372795037921
Energy: 0.8318389663686989
Energy: 0.9280141861867017
Energy: 0.9180865231774624
Energy: -0.4115681979968642
Energy: 0.18974303178525637
Energy: 0.8388943172837717
Energy: 0.8595847307380482
Energy: 0.8416386418131891
Energy: 0.9267348272239876
Energy: 0.8775180890518631
Energy: 0.9163421414499615
Energy: 0.8814144982563745
Energy: 0.9111622133988232
Energy: 0.8694998670264217
Energy: 0.17152025960855183
Energy: 0.8722104869211594
Energy: 0.882390265280985
Energy: 0.8653775376765337
Energy: 0.8677170754068769
Energy: 0.8601352600793203
Energy: 0.8351825034265792
Energy: 0.9496899310370639
Energy: 0.24279431011084565
Energy: 0.23649211124884664
Energy: -0.02119366675884466
Energy: 0.811624217412954
Energy: 0.9006257187195456
Energy: 0.23643636650950434
Energy: 0.8649652244081629
Energy: 0.9217256513428689

minimum gb energy = -0.4115724506051882 eV
minimum distance =  2.25016992158139 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 1.0461366930497555
Energy: 0.6712270174700734
Energy: 0.6071579016447806
Energy: 0.619546742872927
Energy: 0.6526885937722677
Energy: 0.7082073306487071
Energy: 0.6200111825104889
Energy: 0.6639528300251205
Energy: 0.6198026888469774
Energy: 0.7422666787146538
Energy: 0.7375309927829938
Energy: 0.7009456551475735
Energy: 0.6760105728273083
Energy: 0.6420659441228947
Energy: 0.6887987363331695
Energy: 0.7121911200413927
Energy: 0.6741578833320957
Energy: 0.32328983660247895
Energy: 0.68261855423006
Energy: 0.7320501971811185
Energy: 0.6987255416451913
Energy: 0.7316883649300786
Energy: 0.7321982198213927
Energy: 0.7126410631865727
Energy: 0.7274278695072515
Energy: 0.6389653368887271
Energy: 0.6410902950835916
Energy: 0.7215083551837221
Energy: 0.7151635473674243
Energy: 0.7310795375147684
Energy: 0.7216787330234482
Energy: 0.7033453629944686
Energy: 0.7534297656283665
Energy: 0.695363347229057
Energy: 0.9039205848403734
Energy: 0.7015361249779983
Energy: 0.6197421233699523
Energy: 0.7155103125308431
Energy: 0.7151234157578744
Energy: 0.833816645288962
Energy: 0.7486336462364688
Energy: 0.6925329977122222
Energy: 0.7641647989033161
Energy: 0.7255941822800333
Energy: 0.7040276633245728
Energy: 0.6770497473916753
Energy: 0.6941181121921536
Energy: 0.7599369507965393
Energy: 0.7535439558760112
Energy: 0.7290738529210412
Energy: 0.7384567381707701
Energy: 0.6999371852462556
Energy: 0.7354273226852572
Energy: 0.6632835761620637
Energy: 0.7300094058394758
Energy: 0.7369008270907778
Energy: 0.700071666313978
Energy: 0.7125072666155866
Energy: 0.6628123306499659
Energy: 0.755675361726321
Energy: 0.7700277273211437
Energy: 0.7432384171017145
Energy: 0.7457291191372284
Energy: 0.6990680514985661
Energy: 0.7464186589908518
Energy: 0.7786209355994375
Energy: 0.7030876379867971
Energy: 0.7305755859921509
Energy: 0.8182692541072875
Energy: 0.7228051684759191
Energy: 0.6993556826617293
Energy: 0.7307213615299227
Energy: 0.7107359240966115
Energy: 0.697648848405056
Energy: 0.6785152469921572
Energy: 0.8024778103391078
Energy: 0.7246467118174159
Energy: 0.7012180430776422
Energy: 0.6897120176611946
Energy: 0.6868230440609099
Energy: 0.7023137062951144
Energy: 0.7074843221355729
Energy: 0.7040273598026938
Energy: 0.6691125756424569
Energy: 0.7339589659764537
Energy: 0.7035547664659648
Energy: 0.6916596416434768
Energy: 0.22595081195721142
Energy: 0.7184646445133787
Energy: 0.7145579705238727
Energy: 0.7399760487162045
Energy: 0.689383859884858
Energy: 0.6823762759299774
Energy: 0.6906380516532048
Energy: 0.7439267933030052
Energy: 0.7344142091188379
Energy: 0.6837741785550516
Energy: 0.6884484259288999
Energy: 0.6947877998445976
Energy: 0.7420300026942387
Energy: 0.6955704686345602
Energy: 0.684423496124136
Energy: 0.673128304166905
Energy: 0.35256661974903175
Energy: 0.7100614333139991
Energy: 0.713124201681419
Energy: 0.6868023096052336
Energy: 0.6781296017196018
Energy: 0.6785139239758974
Energy: 0.7986279695781491
Energy: 0.69865971452047
Energy: 0.6185064826217654
Energy: 0.6811973353273216
Energy: 0.7049706752008634
Energy: 0.7320374719535392
Energy: 0.6937314593673662
Energy: 0.6796540234170614
Energy: 0.6850800075021221
Energy: 0.6875958528131728
Energy: 0.7266767731042946
Energy: 0.706965148803587
Energy: 0.6729394049519971
Energy: 0.7160590092078036
Energy: 0.716129155921221
Energy: 0.7455313703385523
Energy: 0.724646298068718
Energy: 0.6753633553500367
Energy: 0.6930666550117743
Energy: 0.7177283664343528
Energy: 0.7276782937508339
Energy: 0.686987002805822
Energy: 0.6857250493276918
Energy: 0.6834070103109592
Energy: 0.7080324203895266
Energy: 0.684649208181393
Energy: 0.6913931485882753
Energy: 0.6873288441644051
Energy: 0.6849765687822601
Energy: 0.746175708299529
Energy: 0.684241502841414
Energy: 0.7083888101453283
Energy: 0.7115701047967976
Energy: 0.7213934124837401
Energy: 0.7617407345204736
Energy: 0.7387719565418269
Energy: 0.6941711930557493
Energy: 0.7150182889732452
Energy: 0.7341498133856862
Energy: 0.7554928537478997
Energy: 0.7401886542132975
Energy: 0.8353484967658777
Energy: 0.7200528684448203
Energy: 0.7229380353534891
Energy: 0.7677557289597962
Energy: 0.7442517286286476
Energy: 0.7834750373407757
Energy: 0.7215982374577601
Energy: 0.7238378194373741
Energy: 0.7643611000978702
Energy: 0.7391456311177631
Energy: 0.7664643312335514
Energy: 0.7240006244334052
Energy: 0.7166336943722583
Energy: 0.7223387941336059
Energy: 0.7098153091891695
Energy: 0.741634145062525
Energy: 0.7221838730062969
Energy: 0.7212234105568991
Energy: 0.7075628258649812
Energy: 0.7100502310993356
Energy: 0.7560419557447272
Energy: 0.7563385425762271
Energy: 0.7871022070809043
Energy: 0.728369519006184
Energy: 0.7947528300808926
Energy: 0.7581531889884406
Energy: 0.7532840122483194
Energy: 0.7593152588675477
Energy: 0.7433948627064366
Energy: 0.8204505685395386
Energy: 0.7146121061522134
Energy: 0.7007683180169715
Energy: 0.7382941107408098
Energy: 0.7395312419626148
Energy: 0.7973333928074869
Energy: 0.7253573203806161
Energy: 0.7297254245415871
Energy: 0.7380242601612641
Energy: 0.7393654810302355
Energy: 0.7674819435530632
Energy: 0.758416146948071
Energy: 0.757623939809189
Energy: 0.6757318016655808
Energy: 0.7342039640277502
Energy: 0.7427430755265257
Energy: 0.7599766046263386
Energy: 0.7398719807352069
Energy: 0.7160612279110351
Energy: 0.7392336654221164
Energy: 0.7387037173227358
Energy: 0.7199746376428351
Energy: 0.6980020007270946
Energy: 0.7393829304838949
Energy: 0.7023203535000804
Energy: 0.7275009670171317
Energy: 0.7211023920544661
Energy: 0.7519568239171884
Energy: 0.700479571474635
Energy: 0.69244555235015
Energy: 0.7227023260770717
Energy: 0.7057663903597606
Energy: 0.7205928753388098
Energy: 0.7334647792893678
Energy: 0.8763226637070953
Energy: 0.7041981533495365
Energy: 0.6998796855872534
Energy: 0.7117578034921488
Energy: 0.7330470379781467
Energy: 0.8039706632424953
Energy: 0.7038133632948076
Energy: 0.7013497560060379
Energy: 0.6853637177241895
Energy: 0.7142497172794948
Energy: 0.7336761267011546
Energy: 0.689447315982444
Energy: 0.6984944234644376
Energy: 0.6931401965401004
Energy: 0.7142441215988643
Energy: 0.7390465832679004
Energy: 0.6894793669305997
Energy: 0.6998282162507221
Energy: 0.6824945357346873
Energy: 0.7265759696725423
Energy: 0.7193600202932269
Energy: 0.6845869182906607
Energy: 0.7146618677603164
Energy: 0.6863269502700556
Energy: 0.7296149878703516
Energy: 0.691458848484895
Energy: 0.6855966438554569
Energy: 0.6751996094674831
Energy: 0.7019097781530574
Energy: 0.8057623585379985
Energy: 0.7151506153428648
Energy: 0.6874163048880413
Energy: 0.6855661787812992
Energy: 0.7092921520130926
Energy: 0.8431190188759261
Energy: 0.6970997434330631
Energy: 0.6830032127505693
Energy: 0.6914708098952156
Energy: 0.7045007735317026
Energy: 0.7507174914057058
Energy: 0.6970268933713416
Energy: 0.679614278678203
Energy: 0.6890468575674722
Energy: 0.7013192752788643
Energy: 0.7510107561522029
Energy: 0.6838450445201714
Energy: 0.6716662593610564
Energy: 0.6886255647686506
Energy: 0.7125963275657017
Energy: 0.7086506905264026
Energy: 0.6940937477579587
Energy: 0.6895012859272097
Energy: 0.687685529972241
Energy: 0.7138123259010332
Energy: 0.7084827281384437
Energy: 0.6776053677093753
Energy: 0.6866131725589447
Energy: 0.7113277563851929
Energy: 0.7384750297635349
Energy: 0.7369224368701099
Energy: 0.6978457948575338
Energy: 0.7182047501398297
Energy: 0.7150140824309913
Energy: 0.7489977650604335
Energy: 0.7251546755704806
Energy: 0.7088261767387405
Energy: 0.7127625088322391
Energy: 0.7191048084150579
Energy: 0.9428182773735789
Energy: 0.725075033568614
Energy: 0.7422947138836598
Energy: 0.7412596070116049
Energy: 0.7193874413635033
Energy: 0.7250794737669791
Energy: 0.7139124586034974
Energy: 0.7113162573567753
Energy: 0.5444848318770221
Energy: 0.7505552368139335
Energy: 0.6896314833260637
Energy: 0.7147192162792931
Energy: 0.7434762902930876
Energy: 0.7507867424609606
Energy: 0.7651420834841666
Energy: 0.7245974152405378
Energy: 0.7246601631986818
Energy: 0.7758725255802416
Energy: 0.7416992237763977
Energy: 0.7578376620971117
Energy: 0.7294252906410508
Energy: 0.7087225438813469
Energy: 0.7460389470779196
Energy: 0.750897633075192
Energy: 0.753000619903734
Energy: 0.7258210038859115
Energy: 0.6828189479944117
Energy: 0.7534286719886861
Energy: 0.7494159383952056
Energy: 0.8863764586783844
Energy: 0.73401624635264
Energy: 0.7488383109025246
Energy: 0.7181580758905104
Energy: 0.7327074820300395
Energy: 0.7050070665113626
Energy: 0.7333456498460881
Energy: 0.6908921042830352
Energy: 0.7119703183584833
Energy: 0.6871506508172537
Energy: 0.7132899824757657
Energy: 0.7425535876990593
Energy: 0.8621105971094292
Energy: 0.7589054694454587
Energy: 0.7688866765958479
Energy: 0.7139633703690144
Energy: 0.72803943419197
Energy: 0.7446542572276696
Energy: 0.7300708963052465
Energy: 0.7512397583594985
Energy: 0.7148225997868762
Energy: 0.7119417459979105
Energy: 0.7175529370228275
Energy: 0.6551376704187797
Energy: 0.6874544094586892
Energy: 0.7106004537490028
Energy: 0.7102470284546479
Energy: 0.7182932089148197
Energy: 0.7194751572183037
Energy: 0.7021351144840987
Energy: 0.6919581452453831
Energy: 0.7561183879534088
Energy: 0.7456143326101983
Energy: 0.7089810934085524
Energy: 0.6529022658173061
Energy: 0.6718075709057161
Energy: 0.7330281231370208
Energy: 0.7504030603262041
Energy: 0.7131599742485966
Energy: 0.6692070897959359
Energy: 0.7287266114966292
Energy: 0.7375182896404303
Energy: 0.7224413860410559
Energy: 0.7157271030755995
Energy: 0.6997680509962542
Energy: 0.6806273282005133
Energy: 0.7206358568028829
Energy: 0.6946517885000373
Energy: 0.7128897298701676
Energy: 0.6853044617425815
Energy: 0.6926270336250017
Energy: 0.7183390972582695
Energy: 0.6730033274020156
Energy: 0.6327183307167853
Energy: 0.6680044921444706
Energy: 0.6942464493623188
Energy: 0.7150878023091056
Energy: 0.6611455471656442
Energy: 0.6861544798232156
Energy: 0.6748632078064175
Energy: 0.7388511011548731
Energy: 0.7379966704157376
Energy: 0.6823554774873849
Energy: 0.6067788835416109
Energy: 0.6560839746101599
Energy: 0.7018404226996435
Energy: 0.7026223070054219
Energy: 0.6867966662049232
Energy: 0.6358172316268961
Energy: 0.6973838900712276
Energy: 0.7238424524470486
Energy: 0.32362251023452004
Energy: 0.6753747360817147
Energy: 0.6868675458105693
Energy: 0.6699051520247484
Energy: 0.7152704614994574
Energy: 0.3237635585417639
Energy: 0.6764362018820339
Energy: 0.6770599519514084
Energy: 0.6714138087937431

minimum gb energy = 0.22595081195721142 eV
minimum distance =  2.32481606063113 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 0.3853823698721462
Energy: 0.28521541756817187
Energy: 0.2987358592162329
Energy: 0.2933952455111934
Energy: 0.28632336572424094
Energy: 0.38546816650497595
Energy: 0.29711376341121304
Energy: 0.8158819499495498
Energy: 0.2940077764532195
Energy: 0.28503661462368945
Energy: 0.32236423986268414
Energy: 0.2950209684757517
Energy: 0.3030914913382002
Energy: 0.30280185209801785
Energy: 0.29741132193506914
Energy: 0.2970069044671577
Energy: 0.29579117365643937
Energy: 0.30493028225014984
Energy: 0.30591327695695764
Energy: 0.2970464277543475
Energy: 0.296406499279177
Energy: 0.29819060667990316
Energy: 0.3017195681103762
Energy: 0.29726949062303576
Energy: 0.2835115261852654
Energy: 0.2965998761781281
Energy: 0.30061896288020507
Energy: 0.3010276435091222
Energy: 0.2961055061907827
Energy: 0.28285434876801424
Energy: 0.2836558594766851
Energy: 0.30043074047316676
Energy: 0.2951207829533813
Energy: 0.2950830300579487
Energy: 0.28251911736524327
Energy: 0.2837380199454206
Energy: 0.3041001283216837
Energy: 0.2956531961493426
Energy: 0.2951069440232022
Energy: 0.2826013270157345
Energy: 0.29622580327055653
Energy: 0.29366442929413195
Energy: 0.2960807271120735
Energy: 0.29958171383755333
Energy: 0.2997122403491457
Energy: 0.29568793793020764
Energy: 0.3022260263468513
Energy: 0.2960066926266956
Energy: 0.2984102554239283
Energy: 0.29904246667061907
Energy: 0.29473122136284097
Energy: 0.3002923510804617
Energy: 0.3038650098682002
Energy: 0.28352541612407717
Energy: 0.28471095639513244
Energy: 0.29471476419812803
Energy: 0.30038930308032374
Energy: 0.3009516592412878
Energy: 0.28303749570285763
Energy: 0.2848577821349896
Energy: 0.3039798157102823
Energy: 0.30073762894754574
Energy: 0.2957319072458011
Energy: 0.2829530954713107
Energy: 0.285741346825001
Energy: 0.3059695835605158
Energy: 0.30078708770747825
Energy: 0.2957210684699381
Energy: 0.282845291257064
Energy: 0.29691975487237726
Energy: 0.2987227380844199
Energy: 0.29404239987353326
Energy: 0.29698546582077934
Energy: 0.29876691888513435
Energy: 0.2995955412721594
Energy: 0.29425666123962
Energy: 0.29236754780586705
Energy: 0.29633809332826594
Energy: 0.29982972648511086
Energy: 0.2994104969632013
Energy: 0.29748768845382945
Energy: 0.2967695724300169
Energy: 0.28476852434443994
Energy: 0.28396453818594153
Energy: 0.295261533087095
Energy: 0.2963502093251718
Energy: 0.29786389860520573
Energy: 0.28573626627637566
Energy: 0.2840205109789768
Energy: 0.29443309665860934
Energy: 0.30242790569335604
Energy: 0.2980614524433949
Energy: 0.28421567142513127
Energy: 0.2958226324064687
Energy: 0.2972392931431154
Energy: 0.3028454950754665
Energy: 0.29760529895708937
Energy: 0.2850461441785399
Energy: 0.29569552121271225
Energy: 0.29869508323430044
Energy: 0.29550031803915355
Energy: 0.29495733590666406
Energy: 0.2864302514581314
Energy: 0.29759150497831666
Energy: 0.30017131379933887
Energy: 0.2955413339167197
Energy: 0.28544353501253106
Energy: 0.28490019290176394
Energy: 0.2976321162763226
Energy: 0.30013398219231846
Energy: 0.29401031295290536
Energy: 0.2844089159194945
Energy: 0.2830964080038776
Energy: 0.30033017961836317
Energy: 0.30052254029676256
Energy: 0.2945745146652221
Energy: 0.28393228438894375
Energy: 0.2833999730766562
Energy: 0.3006763519590292
Energy: 0.296517652820191
Energy: 0.298156100331337
Energy: 0.29786720637393194
Energy: 0.2972810107875881
Energy: 0.293723412181406
Energy: 0.29624058342150766
Energy: 0.29832055616750164
Energy: 0.29751920819537253
Energy: 0.2983384567159026
Energy: 0.2943113354650656
Energy: 0.29665145146874217
Energy: 0.28521364808780364
Energy: 0.28340378942912564
Energy: 0.29575757513727735
Energy: 0.29924528095442265
Energy: 0.30587479895930086
Energy: 0.28616187926243725
Energy: 0.2837065663672843
Energy: 0.2956875847004194
Energy: 0.29908309113766085
Energy: 0.30245870874603537
Energy: 0.2843986981492983
Energy: 0.2831415735782968
Energy: 0.3032727393282853
Energy: 0.3052648980774022
Energy: 0.29521589782636953
Energy: 0.283883009718333
Energy: 0.2833837444231899
Energy: 0.30369824938232315
Energy: 0.3044306030263262
Energy: 0.2950998473108337
Energy: 0.29775968681563125
Energy: 0.30255044731542635
Energy: 0.2970865647896734
Energy: 0.2937477958342012
Energy: 0.29482763539893836
Energy: 0.2972794866223322
Energy: 0.3010226601853618
Energy: 0.2972430138001461
Energy: 0.2928302084839065
Energy: 0.2954403051584618
Energy: 0.2825517244850213
Energy: 0.29622922316909006
Energy: 0.2964011144833388
Energy: 0.2969419643089098
Energy: 0.2840162108369777
Energy: 0.282569004417356
Energy: 0.29561222222306816
Energy: 0.29732852461805537
Energy: 0.29589764723394407
Energy: 0.2845555636415195
Energy: 0.28309712823053623
Energy: 0.2965727507382511
Energy: 0.3033156250168261
Energy: 0.3022119291022232
Energy: 0.2961299322076618
Energy: 0.28343993414210755
Energy: 0.29865683699867906
Energy: 0.3057487171240223
Energy: 0.29826729273806063
Energy: 0.29574279795027736
Energy: 0.2974221227210094
Energy: 0.30285330422877305
Energy: 0.29998390501026306
Energy: 0.29468653241082976
Energy: 0.28472783464941437
Energy: 0.29797213472821243
Energy: 0.3022095701678197
Energy: 0.2995014777077453
Energy: 0.2946504446516785
Energy: 0.28579543104413097
Energy: 0.2853630821340083
Energy: 0.29604177276795246
Energy: 0.29282669816644336
Energy: 0.29621102303717045
Energy: 0.2835307733728357
Energy: 0.2868648989149742
Energy: 0.2971615370076692
Energy: 0.2934859509558749
Energy: 0.2849775272286941
Energy: 0.3844274942083859
Energy: 0.2947228445228684
Energy: 0.3015080438061876
Energy: 0.30073955742972674
Energy: 0.3010966471760923
Energy: 0.2975166976735827
Energy: 0.2932172633544907
Energy: 0.297280854222828
Energy: 0.30166612106606344
Energy: 0.2981723357693438
Energy: 0.29700643061047527
Energy: 0.29670009151754756
Energy: 0.3021098230767
Energy: 0.29725490812930816
Energy: 0.2844642012448823
Energy: 0.2842706586739087
Energy: 0.29730642389544704
Energy: 0.30369088897522284
Energy: 0.2983045630803752
Energy: 0.28468106897335727
Energy: 0.2958500485947831
Energy: 0.3014411585295705
Energy: 0.296311696090683
Energy: 0.2947424044942713
Energy: 0.28301859407143953
Energy: 0.28354305606804536
Energy: 0.3007757780898723
Energy: 0.2959922292088726
Energy: 0.29478340545572024
Energy: 0.2825790209964085
Energy: 0.28352980626923735
Energy: 0.29764501762909507
Energy: 0.2961555712095147
Energy: 0.2991272568049399
Energy: 0.3027906819507625
Energy: 0.2967539562960244
Energy: 0.30063268250885045
Energy: 0.29587827487028456
Energy: 0.2991553160602595
Energy: 0.30131367338245785
Energy: 0.2965042644082883
Energy: 0.2985839401256848
Energy: 0.2988438954564415
Energy: 0.28397617908234085
Energy: 0.2853030079700798
Energy: 0.29451205554699045
Energy: 0.29904013523949474
Energy: 0.30445245745487937
Energy: 0.2834606579840577
Energy: 0.28502436583787377
Energy: 0.2939973820751204
Energy: 0.30310235240872396
Energy: 0.29581457816025347
Energy: 0.2839093470920987
Energy: 0.2850579572624658
Energy: 0.3015615271754959
Energy: 0.30222058571437777
Energy: 0.2958246542060543
Energy: 0.28330220247808857
Energy: 0.2851170299546752
Energy: 0.3033722805016739
Energy: 0.29354845560867826
Energy: 0.29539575927793826
Energy: 0.2989241819238351
Energy: 0.3056343462861093
Energy: 0.2989520533960406
Energy: 0.2931236827623886
Energy: 0.29619079686756666
Energy: 0.2986342077459952
Energy: 0.30544241030610936
Energy: 0.2996894232926828
Energy: 0.2958586701781583
Energy: 0.2857046412337032
Energy: 0.2843384397849181
Energy: 0.29786942708602054
Energy: 0.3037458712469072
Energy: 0.29620736810301396
Energy: 0.2842111075217449
Energy: 0.28482757808790315
Energy: 0.29680524888206433
Energy: 0.2967394687899632
Energy: 0.3062561864498119
Energy: 0.29667983231568446
Energy: 0.2846314504500998
Energy: 0.29597463968301563
Energy: 0.30054419378243136
Energy: 0.30249449071810264
Energy: 0.29673144482999203
Energy: 0.2958961219208886
Energy: 0.2962359778428294
Energy: 0.301393169569621
Energy: 0.295197370332607
Energy: 0.28351158972799406
Energy: 0.29808163053400666
Energy: 0.3033773057745922
Energy: 0.29696311507882084
Energy: 0.2952352723621446
Energy: 0.28455268281378215
Energy: 0.2977161809070825
Energy: 0.3070333949964316
Energy: 0.2957937105456695
Energy: 0.2845196680482353
Energy: 0.2832566533875247
Energy: 0.30185300805474113
Energy: 0.2973760539458959
Energy: 0.29228097603865244
Energy: 0.28412510634764526
Energy: 0.28402328027764856
Energy: 0.30124905325995743
Energy: 0.3031288789396501
Energy: 0.2922139481050807
Energy: 0.3045925638115693
Energy: 0.29709916103820166
Energy: 0.2939818246985315
Energy: 0.2958503479458218
Energy: 0.29679880515399343
Energy: 0.3001582396419572
Energy: 0.2976734805371996
Energy: 0.29353089607520844
Energy: 0.29555906905230767
Energy: 0.2968660748462955
Energy: 0.2853783367038054
Energy: 0.2960922325358795
Energy: 0.29962943367284756
Energy: 0.3008653418206394
Energy: 0.29681799788644353
Energy: 0.2849169889436032
Energy: 0.29580097240321834
Energy: 0.3000076582623367
Energy: 0.3011850864753601
Energy: 0.2858263897761811

minimum gb energy = 0.28251911736524327 eV
minimum distance =  2.45313623237759 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.6887110964893474
Energy: 0.6221516347103406
Energy: 0.6160627062428478
Energy: 0.5948769660807088
Energy: 0.6038780735896143
Energy: 0.5981749492492057
Energy: 0.6211967224039975
Energy: 0.6532681239027438
Energy: 0.6178681963023772
Energy: 0.6125492392720935
Energy: 0.7856125303136317
Energy: 0.6112516942409234
Energy: 0.6401407622630518
Energy: 0.6324454877438432
Energy: 0.6230328010468791
Energy: 0.7090011683785744
Energy: 0.6581835277237087
Energy: 0.6372809203828665
Energy: 0.6727531330710576
Energy: 0.6104999945322811
Energy: 0.6068793965716412
Energy: 0.6282783000445726
Energy: 0.6542466956209879
Energy: 0.6210842133810401
Energy: 0.5997164376580055
Energy: 0.6053044633463585
Energy: 0.6035870461759101
Energy: 0.6170260861126222
Energy: 0.6422295569539829
Energy: 0.875206932827003
Energy: 0.6285788049578948
Energy: 0.6371180994907667
Energy: 0.6239551485498102
Energy: 0.6263623258613698
Energy: 0.7354877950236515
Energy: 0.6186302049132595
Energy: 0.6355407299984637
Energy: 0.6364171600441308
Energy: 0.6310952106884468
Energy: 0.6414169323117642
Energy: 0.6330515953916598
Energy: 0.634906737046778
Energy: 0.641791857735954
Energy: 0.6185982532731309
Energy: 0.5921906593255716
Energy: 0.6336575302600076
Energy: 0.627502140087481
Energy: 0.6443793567100724
Energy: 0.6267921488448173
Energy: 0.6991413485935879
Energy: 0.5789993779146959
Energy: 0.6244503349155958
Energy: 0.6936975730892858
Energy: 0.5899956267677096
Energy: 0.600188503000971
Energy: 0.5781188727441297
Energy: 0.6237985501629664
Energy: 0.6989402913964521
Energy: 0.5900906956480831
Energy: 0.6059018661895044
Energy: 0.5810971736829292
Energy: 0.5767533580438209
Energy: 0.6188712821264135
Energy: 0.5963453633957104
Energy: 0.6178619008365179
Energy: 0.5942455934387805
Energy: 0.5748902798956802
Energy: 0.6162726102732702
Energy: 0.8525470805396188
Energy: 0.6101617773742098
Energy: 0.5971652589215978
Energy: 0.6351203089441628
Energy: 0.6071819090449849
Energy: 0.612330643950629
Energy: 0.6193008116965822
Energy: 0.5980015559841177
Energy: 0.6181984601013315
Energy: 0.6067179813741053
Energy: 0.6157617897418367
Energy: 0.6312531502965851
Energy: 0.6289586779292082
Energy: 0.6078830717355826
Energy: 0.5994240488439668
Energy: 0.5996105255404983
Energy: 0.5670961600798636
Energy: 0.6100169118396802
Energy: 0.6088573577989655
Energy: 0.5995673135676381
Energy: 0.609283007965823
Energy: 0.5766010450891728
Energy: 0.5880304693937068
Energy: 0.6133880541647417
Energy: 0.5979201088908519
Energy: 0.6074658097698381
Energy: 0.6069173560617274
Energy: 0.5685951533717997
Energy: 0.5982236003908615
Energy: 0.7601359003413899
Energy: 0.6069613727904231
Energy: 0.6132860436435931
Energy: 0.650560131020824
Energy: 0.5678253370768205
Energy: 0.5971929205662619
Energy: 0.6095360273546122
Energy: 0.6060198592007836
Energy: 0.6404813357181272
Energy: 0.567027906165354
Energy: 0.6069306579992273
Energy: 0.6107849805648328
Energy: 0.6046823620430812
Energy: 0.5824147950530292
Energy: 0.6101930000967396
Energy: 0.6026518839248363
Energy: 0.5675399398240101
Energy: 0.6814771270370031
Energy: 0.6095637106581796
Energy: 0.5917406869887665
Energy: 0.5944255604334053
Energy: 0.5752001155390777
Energy: 0.6495064827412794
Energy: 0.5776236945131067
Energy: 0.6543368941535911
Energy: 0.6108900660066485
Energy: 0.6049247053090773
Energy: 0.5987005478085079
Energy: 0.5884096882488448
Energy: 0.6537987857743361
Energy: 0.6112431604257665
Energy: 0.6075350898961939
Energy: 0.6443501494795757
Energy: 0.5877151393789614
Energy: 0.5670099020824112
Energy: 0.6051793697063412
Energy: 0.610833538712905
Energy: 0.6110608436541677
Energy: 0.5784283442819468
Energy: 0.5967716131269237
Energy: 0.60586692805554
Energy: 0.6183541401046132
Energy: 0.6191126145959879
Energy: 0.6028074958921716
Energy: 0.5960203259862162
Energy: 0.5990418188859815
Energy: 0.5678931522415455
Energy: 0.6063977339999975
Energy: 0.6221676447854861
Energy: 0.5851450934630679
Energy: 0.6129273893263972
Energy: 0.5665785789879835
Energy: 0.6058767415750576
Energy: 0.5946768958840524
Energy: 0.624583201390279
Energy: 0.5987887390960518
Energy: 0.59765760721611
Energy: 0.5832290818209053
Energy: 0.6113381261112876
Energy: 0.6189759713058259
Energy: 0.6027277615969246
Energy: 0.7540807911800965
Energy: 0.5837268496562416
Energy: 0.63531150868783
Energy: 0.6183450040372707
Energy: 0.6233708609544742
Energy: 0.6152033238955966
Energy: 0.637028026852463
Energy: 0.5821871820846648
Energy: 0.6220383682888982
Energy: 0.6237773449902011
Energy: 0.6239337273171018
Energy: 0.6325606370677982
Energy: 0.590543139577929
Energy: 0.6085319080482715
Energy: 0.5976709643372038
Energy: 0.5975523621266585
Energy: 0.622137311053114
Energy: 0.6192300325391565
Energy: 0.6158948105656258
Energy: 0.5978946210570472
Energy: 0.604395218039679
Energy: 0.5898981930559862
Energy: 0.5990636731605272
Energy: 0.620852883606492
Energy: 0.6196869710061693
Energy: 0.6245390519848829
Energy: 0.6591180821895941
Energy: 0.6256544010884755
Energy: 0.6210093351332846
Energy: 0.6862516972045171
Energy: 0.6275402234991985
Energy: 0.660180686329582
Energy: 0.6095359507435665
Energy: 0.6061800667532958
Energy: 0.6085924638586047
Energy: 0.6196023625652319
Energy: 0.6026160349726927
Energy: 0.5986185701560113
Energy: 0.6054034960412832
Energy: 0.6084905078930675
Energy: 0.6177994718209461
Energy: 0.6966279224843009
Energy: 0.6055197453369462
Energy: 0.6052986503055013
Energy: 0.6036432447089599
Energy: 0.5908252836870622
Energy: 0.6459811679170674
Energy: 0.6100828890578298
Energy: 0.6057850910025377
Energy: 0.6037818537551105
Energy: 0.5902078466943912
Energy: 0.6509699361409182
Energy: 0.6367326831262051
Energy: 0.6622813088074813
Energy: 0.6236020099774667
Energy: 0.641177032025119
Energy: 0.6461443539763772
Energy: 0.6407799456714655
Energy: 0.725400602956056
Energy: 0.6262856608890502
Energy: 0.6387846182112397
Energy: 0.6495425232547779
Energy: 0.646275760196107
Energy: 0.5970588027873677
Energy: 0.6370806755696209
Energy: 0.6156795058332034
Energy: 0.6592888248880177
Energy: 0.6089850390939644
Energy: 0.5971583347169442
Energy: 0.6362375512499063
Energy: 0.6162598070388984
Energy: 0.6622423606441972
Energy: 0.613589017059368
Energy: 0.601422505534716
Energy: 0.6352011354430152
Energy: 0.6543089918242811
Energy: 0.6312596772920065
Energy: 0.6183660293943037
Energy: 0.6013449518487904
Energy: 0.6343443109947506
Energy: 0.6193373277450024
Energy: 0.6388222860980088
Energy: 0.7045566176149063
Energy: 0.6552381066123818
Energy: 0.6376686848350677
Energy: 0.644346556073056
Energy: 0.6116295792435023
Energy: 0.7235684971702281
Energy: 0.6560192256982497
Energy: 0.6361746088462339
Energy: 0.6478710676863721
Energy: 0.6172988324583598
Energy: 0.6000514937887624
Energy: 0.6213314040834836
Energy: 0.5931183946334503
Energy: 0.5913050850472803
Energy: 0.6067454456081861
Energy: 0.5962377669807384
Energy: 0.6176308505292059
Energy: 0.630791310178124
Energy: 0.5915114778240477
Energy: 0.6059733185361247
Energy: 0.7129793752230502
Energy: 0.6112600009260631
Energy: 0.5766410671365234
Energy: 0.5769358603512451
Energy: 0.6265350862496569
Energy: 0.601957539077123
Energy: 0.6110499853897247
Energy: 0.5768279957103255
Energy: 0.6019194459575581
Energy: 0.6580970288718448
Energy: 0.593665514561878
Energy: 0.6259385218288118
Energy: 0.5967700713610836
Energy: 0.5814756821373017
Energy: 0.6153020665443825
Energy: 0.5906895134154784
Energy: 0.628954428641929
Energy: 0.612002535354976
Energy: 0.5834966778025101
Energy: 0.7546356459168236
Energy: 0.6045827752430234
Energy: 0.5674854021618551
Energy: 0.5701694068102349
Energy: 0.6122832237575658
Energy: 0.5926476707985346
Energy: 0.6162479543459287
Energy: 0.5677977871481603
Energy: 0.5763031544069012
Energy: 0.612846472187408
Energy: 0.7081934801308811
Energy: 0.6067234413278508
Energy: 0.6118257548522882
Energy: 0.5607489067691013
Energy: 0.6328512092771675
Energy: 0.6296955967740574
Energy: 0.6086578501753551
Energy: 0.5790179479086619
Energy: 0.5675607214326599
Energy: 0.6114470500540178
Energy: 0.6096064650340461
Energy: 0.6081282809191896
Energy: 0.6914965014489992
Energy: 0.5786912917175198
Energy: 0.5582094995363358
Energy: 0.6056779729758289
Energy: 0.6087563396251944
Energy: 0.656438064022998
Energy: 0.5786643355724236
Energy: 0.656613309214491
Energy: 0.5991095308135282
Energy: 0.5745281873423398
Energy: 0.570424813841662
Energy: 0.6073111617219243
Energy: 0.5926060581271675
Energy: 0.5692627746930448
Energy: 0.5567897964830086
Energy: 0.5704469441905323
Energy: 0.6055360676682638
Energy: 0.5924595784221646
Energy: 0.5671162920098621
Energy: 0.6022032813160144
Energy: 0.5757215002054654
Energy: 0.6143534256879729
Energy: 0.6267010584446696
Energy: 0.6080097542892883
Energy: 0.6069421340905345
Energy: 0.5652503165766816
Energy: 0.6090222971946521
Energy: 0.6274238254244247
Energy: 0.6083130518068616
Energy: 0.6277225411249286
Energy: 0.6126755024877328
Energy: 0.6708029261609456
Energy: 0.6118541956122958
Energy: 0.6081888852749563
Energy: 0.8419201213869039
Energy: 0.613985968002682
Energy: 0.6738468372000271
Energy: 0.6155979878164621
Energy: 0.608300557877413
Energy: 0.5735896837569561
Energy: 0.6140508513953415
Energy: 0.6040990053690678
Energy: 0.5690311013390096
Energy: 0.6060448355394364
Energy: 0.5731104472068576
Energy: 0.6081639107232679
Energy: 0.6056690469995294
Energy: 0.568200133741439
Energy: 0.6051139779478062
Energy: 0.5996853942750189
Energy: 0.5826995494865034
Energy: 0.6063819588391562
Energy: 0.6382937042338287
Energy: 0.6081287922108812
Energy: 0.6105648301516995
Energy: 0.5838005726659546
Energy: 0.6110425601341994
Energy: 0.6343715057297792
Energy: 0.6093698305395084
Energy: 0.615273851844038
Energy: 0.5834217381676345
Energy: 0.5971459826406735
Energy: 0.600462783997645
Energy: 0.5983734097895496
Energy: 0.6131440471535159
Energy: 0.5965117482434327
Energy: 0.6017262360605866
Energy: 0.6147033197971677
Energy: 0.8668526670223197
Energy: 0.6047527869762699
Energy: 0.5893061145921836
Energy: 0.6390516714398858
Energy: 0.616658993721673
Energy: 0.6183236608367144
Energy: 0.6105425690673222
Energy: 0.5908191307952458
Energy: 0.5934170679313788
Energy: 0.6181674861832587
Energy: 0.7047097037321514
Energy: 0.6137633383353137
Energy: 0.6032562677686192
Energy: 0.6269787624278215
Energy: 0.639330728993923
Energy: 0.6146210167717715
Energy: 0.6115112244033601
Energy: 0.6027540043551408
Energy: 0.6250023677282829
Energy: 0.6049395093061494
Energy: 0.625278393372697
Energy: 0.6012661029170265
Energy: 0.66065552251074
Energy: 0.7026714165595372
Energy: 0.5979464461701122
Energy: 0.6087944280353385
Energy: 0.6029693789992566
Energy: 0.6850747111915865
Energy: 0.6662131594175338
Energy: 0.5981440487893193
Energy: 0.6138024210001801
Energy: 0.6561558353408743
Energy: 0.6630821629237138
Energy: 0.5961951637089447
Energy: 0.6018264338800144
Energy: 0.6051550372204472
Energy: 0.6629211646509618
Energy: 0.6495868195778106
Energy: 0.624523318191838
Energy: 0.5970168447387284
Energy: 0.642330425103314
Energy: 0.6389148893499255
Energy: 0.6544233685112749
Energy: 0.6364222112909345
Energy: 0.6215863507104156
Energy: 0.6376274137426826
Energy: 0.6068351061599233
Energy: 0.6463166002274611
Energy: 0.640723749383874
Energy: 0.6169185899623086
Energy: 0.6355698742284024
Energy: 0.595047847933136
Energy: 0.6267639577577018
Energy: 0.6041272673429434
Energy: 0.6068180895325934
Energy: 0.6275449588806962
Energy: 0.602516436975121
Energy: 0.6354447070770526
Energy: 0.5963754089575982
Energy: 0.6065231993512384
Energy: 0.6286293130394567
Energy: 0.6734266965572633
Energy: 0.6383545304116494
Energy: 0.6361051999465273
Energy: 0.6319362819133592
Energy: 0.6413409471714543
Energy: 0.63716950094073
Energy: 0.6853051950110046
Energy: 0.6376241005341287
Energy: 0.632233875780994
Energy: 0.643132107564874
Energy: 0.6424457959615808
Energy: 0.6185609787388554
Energy: 0.6002310844244898
Energy: 0.5796136916779578
Energy: 0.646619917293934
Energy: 0.6351504223509296
Energy: 0.6183923672986795
Energy: 0.6184866813793072
Energy: 0.5938690578770027
Energy: 0.6413200658835561
Energy: 0.5847465470710841
Energy: 0.6045334986569916
Energy: 0.5957095687734121
Energy: 0.588790134894167
Energy: 0.6590240861824916
Energy: 0.6196560427699848
Energy: 0.5961161704500216
Energy: 0.5956004561494269
Energy: 0.5800848044603657
Energy: 0.6501498028305226
Energy: 0.6660235241069392
Energy: 0.6227459031648512
Energy: 0.6167586224585678
Energy: 0.6168335619629516
Energy: 0.57504127017056
Energy: 0.6692170929428061
Energy: 0.6158568564868666
Energy: 0.617564742990084
Energy: 0.5821084471954393
Energy: 0.6391728061899161
Energy: 0.6040856502944735
Energy: 0.7246654575374399
Energy: 0.6046327861111852
Energy: 0.6283575934207816
Energy: 0.713803122144438
Energy: 0.6008449258562769
Energy: 0.5962466191193062
Energy: 0.6100317231139928
Energy: 0.619494839714153
Energy: 0.7008420710696215
Energy: 0.6192976397143646
Energy: 0.5695101813821857
Energy: 0.6134138018872887
Energy: 0.5600632119250314
Energy: 0.6109087832683873
Energy: 0.6051746865234016
Energy: 0.5701661580616945
Energy: 0.665005975126592
Energy: 0.6112541326219546
Energy: 0.6172638938196913
Energy: 0.6096939762838699
Energy: 0.616414372566209
Energy: 0.6082381242792435
Energy: 0.5689163490068622
Energy: 0.5697472213521655
Energy: 0.6226056404249807
Energy: 0.6255071246607311
Energy: 0.6078036180328904
Energy: 0.6269333620301554
Energy: 0.6018563849656502
Energy: 0.6314744954102466
Energy: 0.6002495685903635
Energy: 0.6058515246484024
Energy: 0.5976548002587729
Energy: 0.6399425148230169
Energy: 0.5917312942824619
Energy: 0.6009588699979992
Energy: 0.6066384403071979
Energy: 0.576270441745898
Energy: 0.6489134015270352
Energy: 0.6794739258381878
Energy: 0.5687536188508647
Energy: 0.604066317898756
Energy: 0.6042481614087905
Energy: 0.6136051048562965
Energy: 0.6891987367845642
Energy: 0.5757060844768208
Energy: 0.6039750263558287
Energy: 0.6075830127316175
Energy: 0.6037902653960183
Energy: 0.6118343652405424
Energy: 0.606335103263049
Energy: 0.5827250914683828
Energy: 0.5742382963349439
Energy: 0.6773444323944604
Energy: 0.6031572356471742
Energy: 0.60929000115877
Energy: 0.5749950138377425
Energy: 0.5745226039771235
Energy: 0.6723429515120074
Energy: 0.6089823664016412
Energy: 0.5877904140806499
Energy: 0.5980483082728599
Energy: 0.6092310013100821
Energy: 0.5662080584845971
Energy: 0.6033230621566238
Energy: 0.6075303180115361
Energy: 0.5979536457691331
Energy: 0.6020992878015916
Energy: 0.5679326497880259
Energy: 0.5671244291219705
Energy: 0.6067751754254875
Energy: 0.6022177804551518
Energy: 0.5928203596841018
Energy: 0.6230476030441553
Energy: 0.5775398324371723
Energy: 0.6007181048230376
Energy: 0.6734618745002863
Energy: 0.5670322211240969
Energy: 0.6726191543252931
Energy: 0.6173344727749084
Energy: 0.6204636756888879
Energy: 0.6049246535277663
Energy: 0.6084875573306382
Energy: 0.6257029736418859
Energy: 0.6145950684166054
Energy: 0.5975842138026021
Energy: 0.605253931407508
Energy: 0.6337108101875056
Energy: 0.6101802586999977
Energy: 0.6088208237191185
Energy: 0.5983010643154432
Energy: 0.6083461604608068
Energy: 0.5894784182443903
Energy: 0.6823943641440704
Energy: 0.6035003492596164
Energy: 0.5974004377807106
Energy: 0.6048994094773339
Energy: 0.5749910717115344
Energy: 0.6944376304230444
Energy: 0.6112306178340488
Energy: 0.6002846285840153
Energy: 0.616566564971113
Energy: 0.6025615503442682
Energy: 0.5719749082611816
Energy: 0.6119266195632994
Energy: 0.5983719803939607
Energy: 0.6339288172707086
Energy: 0.6014222830673243
Energy: 0.5714003268681954
Energy: 0.7150736899156486
Energy: 0.6131984946212345
Energy: 0.6664076788372553
Energy: 0.6026359345003166
Energy: 0.6214463555287739
Energy: 0.7582572336400665
Energy: 0.6190362707883986
Energy: 0.6477889209776941
Energy: 0.6012434483895851
Energy: 0.6114724955929268
Energy: 0.8714887396359735
Energy: 0.6249143625172436
Energy: 0.621605452856026
Energy: 0.5764291062669258
Energy: 0.6009967795425076
Energy: 0.5948973011884261
Energy: 0.6212529739894902
Energy: 0.6083993760167038
Energy: 0.6025924149664014
Energy: 0.6114418139576966

minimum gb energy = 0.5567897964830086 eV
minimum distance =  2.31577111822685 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 0.9448055354528242
Energy: 0.8537987220258672
Energy: 0.8695638007742965
Energy: 0.8685716059076781
Energy: 0.8508021792618915
Energy: 0.851580468065465
Energy: 0.8695477190648455
Energy: 0.9168769167902637
Energy: 0.8681854387212085
Energy: 0.8492916134660511
Energy: 0.7732206175017383
Energy: 0.8824368803648358
Energy: 0.8941650671295559
Energy: 0.8935207347058877
Energy: 0.8681903361351083
Energy: 0.8307819906558925
Energy: 0.8830235069993017
Energy: 0.8945552504998032
Energy: 0.8933317662207524
Energy: 0.8318312449893477
Energy: 0.8681055048977974
Energy: 0.8948332284394406
Energy: 0.9770047279132895
Energy: 0.884199233882269
Energy: 0.8872591000823479
Energy: 0.8816608517327127
Energy: 0.8948341661415606
Energy: 0.9767988928023429
Energy: 0.8827725385882509
Energy: 0.8868638064367657
Energy: 0.8722259169135699
Energy: 0.9615200544353055
Energy: 0.8672572718729331
Energy: 0.8817856333166917
Energy: 0.8641668298943049
Energy: 0.8582017320805682
Energy: 0.9619664450717249
Energy: 0.8704082566866714
Energy: 0.8822134488096942
Energy: 0.8879855393742773
Energy: 0.8767701353329705
Energy: 0.8433120781349606
Energy: 1.0415925553328542
Energy: 0.8764278705230194
Energy: 0.8305946349936735
Energy: 0.8849846426166988
Energy: 0.896585840794679
Energy: 1.0418039570609043
Energy: 0.8771375147837667
Energy: 0.8305110470692508
Energy: 0.8596544359096949
Energy: 0.8393835840782361
Energy: 0.8704466934291453
Energy: 0.9640560405929122
Energy: 0.832904115571904
Energy: 0.8597676432444757
Energy: 0.8354737073251466
Energy: 0.857344932405742
Energy: 0.9643416658086059
Energy: 0.8331665352610201
Energy: 0.8481589961493615
Energy: 0.8400983056669934
Energy: 0.8702135760947244
Energy: 0.8595374930326181
Energy: 0.8579790399145034
Energy: 0.8484428225847345
Energy: 0.8391315745289747
Energy: 0.870270839632959
Energy: 0.8752054342171207
Energy: 0.8585493188799336
Energy: 0.8678799728469155
Energy: 0.8932352880830471
Energy: 0.8613640845585324
Energy: 0.843692663821699
Energy: 0.8591708961562653
Energy: 0.8683161507300443
Energy: 0.8939317248819483
Energy: 0.9075072561389917
Energy: 0.876334167156214
Energy: 0.8588069441458652
Energy: 0.7733454604512563
Energy: 0.8693222231141329
Energy: 0.8668569728842086
Energy: 0.8672413203745863
Energy: 0.8820109513497288
Energy: 0.8480619293221864
Energy: 0.868429320866622
Energy: 0.8670241558227654
Energy: 0.8840226519243389
Energy: 0.8830530441115434

minimum gb energy = 0.7732206175017383 eV
minimum distance =  2.32924441937856 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 1.1052022595908657
Energy: 1.086976469095054
Energy: 1.0624320848240487
Energy: 1.074636523082833
Energy: 0.8619943442625507
Energy: 1.1526880289352894
Energy: 1.020144070917993
Energy: 1.0652434311331573
Energy: 1.0733911375226295
Energy: 0.9343950009167186
Energy: 1.0717465667841686
Energy: 0.9935706607674502
Energy: 1.0156195251829006
Energy: 1.0191200572649026
Energy: 0.9954841240738002
Energy: 1.074700605568047
Energy: 0.9930422850515481
Energy: 1.0792401107888145
Energy: 1.0211181763291801
Energy: 0.9967307307366587
Energy: 1.0898039318468213
Energy: 1.005048377374936
Energy: 1.0022975566417305
Energy: 1.0819336542653606
Energy: 1.0819860347345556
Energy: 1.0867148215317677
Energy: 1.0027195413355274
Energy: 1.0055140324779073
Energy: 1.0395761522980174
Energy: 1.075138917251723
Energy: 1.122848997983195
Energy: 1.054570748282743
Energy: 1.118209442051058
Energy: 1.03348784428691
Energy: 1.1413644146323514
Energy: 1.0019420977738873
Energy: 1.054926263115491
Energy: 1.1170872694378975
Energy: 1.0744900754152693
Energy: 1.1293435509506677
Energy: 1.0917586154945924
Energy: 0.9369239564228491
Energy: 1.1107559643102105
Energy: 1.1030786918458586
Energy: 1.0084574541424103
Energy: 1.0999004792313727
Energy: 1.0501866135192157
Energy: 1.065670988321023
Energy: 1.0635170466641477
Energy: 1.0061063085070814
Energy: 0.9995570304705755
Energy: 1.0659069322149295
Energy: 1.0141819571860458
Energy: 1.097882337361185
Energy: 0.9970300755824236
Energy: 1.0232250925471311
Energy: 1.077030391327183
Energy: 1.1300062339049881
Energy: 1.0954813611357264
Energy: 0.9967978635384813
Energy: 1.158173156972913
Energy: 1.084915667215352
Energy: 1.011508286180721
Energy: 1.0772827417889386
Energy: 1.0328996931587324
Energy: 1.1696067445723168
Energy: 1.1392443711950488
Energy: 1.007262887474844
Energy: 1.0575878064997184
Energy: 1.089328474937734
Energy: 1.01673171491859
Energy: 1.0095157528995824
Energy: 1.0235436741269943
Energy: 1.1030066571973332
Energy: 1.0024545150629012
Energy: 1.03505740324803
Energy: 1.0101246347366388
Energy: 1.0245762655709219
Energy: 1.1012483611431414
Energy: 1.003168533046099
Energy: 1.0746732597189563
Energy: 1.0607081460436976
Energy: 1.0100754142165884
Energy: 1.0022282164556866
Energy: 1.1095097040727027
Energy: 1.073667682587585
Energy: 1.0583500614969872
Energy: 1.0098845785394497
Energy: 1.077063956817975
Energy: 0.9904502920733051
Energy: 1.1083768991047316
Energy: 1.0271087170104578
Energy: 1.097440180563034
Energy: 1.019160367849079
Energy: 1.0146533726026765
Energy: 1.1157090187266288
Energy: 1.0228087783934106
Energy: 0.9341830133084803
Energy: 1.0216162706928433
Energy: 1.0142698086949684
Energy: 1.0645365035358993
Energy: 1.0690214536746296
Energy: 1.1092528251221063
Energy: 1.0419313988997174
Energy: 0.9826847448276703
Energy: 1.0636236341665035
Energy: 0.9632721855831778
Energy: 1.1109273208696804
Energy: 1.045801661842758
Energy: 1.0034715586168728
Energy: 1.0736484108389417
Energy: 1.0608658960887558
Energy: 0.9985353574770333
Energy: 1.0869398790479365
Energy: 1.0660169077533568
Energy: 1.0747054648061174
Energy: 1.0598847434790386
Energy: 1.0727799677867724
Energy: 1.0480937937051187
Energy: 1.067937285804004
Energy: 1.0790013327350894
Energy: 1.0685855194856626
Energy: 1.1262053680490542
Energy: 1.069900647530657
Energy: 1.0660442175887581
Energy: 1.0851274371475015
Energy: 1.0687641173407756
Energy: 1.125948160864662
Energy: 1.0672328993264182
Energy: 1.0646228884040316
Energy: 1.0656280327531436
Energy: 1.0592001328471565
Energy: 1.0828705877150373
Energy: 1.097779657947726
Energy: 1.1050342608890333
Energy: 1.0672577004792492
Energy: 1.0600363107349398
Energy: 1.0685917411234709
Energy: 1.1015897517858448
Energy: 1.090543910249524
Energy: 1.1298053140508468
Energy: 1.1205691453113094
Energy: 1.0202333225737397
Energy: 1.0585863989011244
Energy: 1.1067309164956556
Energy: 1.0989503606798219
Energy: 1.0769943239347162
Energy: 1.0210089071402575
Energy: 1.0596439764479701
Energy: 1.1013050508105935
Energy: 1.0509982286872896
Energy: 1.0986516868421894
Energy: 1.0130433134324504
Energy: 1.056896141049632
Energy: 0.9993300924194612
Energy: 1.010000839739671
Energy: 1.09721043269859
Energy: 1.0141386820747562
Energy: 1.0561684337309891
Energy: 0.9974653787476399
Energy: 1.0029809608568891
Energy: 1.103654923112532
Energy: 1.0931380924090692
Energy: 1.0416310944310494
Energy: 1.0010012299437396
Energy: 1.0144997017537392
Energy: 1.1026241209077332
Energy: 1.1037538431666198
Energy: 0.9967447112053942
Energy: 0.908568485202424
Energy: 0.9992609802033244
Energy: 1.088816539559302
Energy: 1.0012261904664002
Energy: 1.092174214880541
Energy: 1.0218619166112035
Energy: 1.0254027695395185
Energy: 1.0835348792548647
Energy: 1.0292042507956087
Energy: 1.1011009419232143
Energy: 1.0071875560597243
Energy: 0.9921582893165827
Energy: 1.072900662401449
Energy: 1.0831730721470931
Energy: 1.0779577212288665
Energy: 1.0895455989101157
Energy: 0.9923172630953949
Energy: 1.083548167082631
Energy: 1.011976607241009
Energy: 1.0760805302349492
Energy: 1.09228948560342
Energy: 1.050116005067448
Energy: 1.086237122931451
Energy: 1.095598172533041
Energy: 1.0501249813226998
Energy: 1.0730345478573067
Energy: 1.0496720438242326
Energy: 0.9485505395908571
Energy: 1.136646268273865
Energy: 1.0492261836477195
Energy: 1.0669031401219689
Energy: 1.1128218771146554
Energy: 0.9500418925403067
Energy: 1.046930926934516
Energy: 1.0915517629267075
Energy: 1.0372148772959227
Energy: 1.0949029782415092
Energy: 0.9501618242324479
Energy: 0.9933645491995363
Energy: 1.0937748555835771
Energy: 0.9392586430126109
Energy: 0.9929336926026899
Energy: 1.1059843072523123
Energy: 1.0005483952805085
Energy: 1.0073430175626372
Energy: 1.0583466696216919
Energy: 0.9937963134417044
Energy: 1.1044000232893194
Energy: 0.9993237771295645
Energy: 1.0087046047630568
Energy: 1.077501102920053
Energy: 1.1071713778572745
Energy: 0.9969547896363342
Energy: 1.0925556490840218
Energy: 0.9936919123236174
Energy: 1.0892370899463883
Energy: 1.0113967684783591
Energy: 0.9975633726428397
Energy: 1.094375754233487
Energy: 1.0062405493480084
Energy: 1.1569470728773519
Energy: 1.0216738226854394
Energy: 1.090354680696641
Energy: 1.081287999672609
Energy: 1.0118177924042662
Energy: 1.0903250991471258
Energy: 1.0207612485534507
Energy: 1.1150667583561882
Energy: 0.9983198839743983
Energy: 1.0143770656352857
Energy: 1.0740070159863004
Energy: 1.0144179100778248
Energy: 0.9992333179947368
Energy: 1.1074612972766777
Energy: 1.0875525083521553
Energy: 1.0770580974451656
Energy: 1.0122851886129753
Energy: 0.9988127812357395
Energy: 1.1095719350075792
Energy: 1.0867987235640038
Energy: 1.0653598157871802
Energy: 1.0836876520504064
Energy: 1.0319094882384994
Energy: 1.061271416999984
Energy: 1.1254931446439418
Energy: 1.0198611640122621
Energy: 1.0998284012696886
Energy: 1.0250859416856826
Energy: 1.061852613340634
Energy: 1.1020394727170593
Energy: 1.0170007634129774
Energy: 0.860859218033733
Energy: 1.0609355393878945
Energy: 0.9701055892471144
Energy: 1.0837219834589853
Energy: 1.0983619564135518
Energy: 1.0452701243354976
Energy: 1.0894190063591909
Energy: 0.9704981896387844
Energy: 1.085135026089639
Energy: 1.0410593246679183
Energy: 1.0180322190493274
Energy: 0.9625885918542396
Energy: 1.0668520604705867
Energy: 1.0726793220397557
Energy: 1.0670241467542225
Energy: 1.0189930403438145
Energy: 0.9339729384025041
Energy: 1.066558373356399
Energy: 1.0745181444063012
Energy: 1.063148869004897
Energy: 1.074951641048846
Energy: 1.0875264082629315
Energy: 1.0774735176433612
Energy: 1.0685441927755381
Energy: 1.0476050849406406
Energy: 1.0740416425896933
Energy: 1.086257931145133
Energy: 1.072830053105635
Energy: 1.0684398360487712
Energy: 1.0590747411952703
Energy: 1.1109011843567842
Energy: 1.1438636056182048
Energy: 1.103968870503481
Energy: 1.0845212543646887
Energy: 1.0827480794262445
Energy: 1.234737371589753
Energy: 1.1419343634732952
Energy: 1.1283334544131391
Energy: 1.0704065612224634
Energy: 1.05201860882728
Energy: 1.0147704059036886
Energy: 1.0777927216966372
Energy: 1.0816209115998807
Energy: 1.0510795988976875
Energy: 1.124535980733741
Energy: 1.0168109361799529
Energy: 1.0775280824766367
Energy: 1.0820442188488555
Energy: 1.050057743175776
Energy: 1.0953343355659266
Energy: 1.0119024808764556
Energy: 1.105874747635378
Energy: 1.0761630158593676
Energy: 1.0675454730087124
Energy: 1.119175186864518
Energy: 1.0105602485291185
Energy: 1.0930606087575276
Energy: 1.0763047751479733
Energy: 0.9920510535272521
Energy: 1.096825472077815
Energy: 1.06254959552824
Energy: 1.2640471456753835
Energy: 1.1070436683909401
Energy: 1.0039483103169209
Energy: 1.0975691104810779
Energy: 1.0655005164255649
Energy: 1.2659057518152455
Energy: 1.0847612846320485
Energy: 1.001236856486154
Energy: 1.0990404150654882
Energy: 1.0009531793269626
Energy: 1.0807796232844062
Energy: 1.1085866647520854
Energy: 1.0106433859715713
Energy: 1.0872558736130107
Energy: 1.0023114505847626
Energy: 1.090074758903026
Energy: 1.1075506768281573
Energy: 1.0129787424751995
Energy: 1.082526709432535
Energy: 0.959247393766511
Energy: 1.075585449913676
Energy: 1.0591492460010055
Energy: 0.9922937020717154
Energy: 1.0836333672630514
Energy: 1.0507887152301312
Energy: 1.0745511299304946
Energy: 1.0560509495974886
Energy: 0.9906859065877524
Energy: 1.0858171599767434
Energy: 0.9004821642104549
Energy: 1.1103694231954984
Energy: 0.9539819047894438
Energy: 1.0134295117994656
Energy: 0.9725622561573471
Energy: 1.0220184918140807
Energy: 1.134779233989057
Energy: 0.9547094557413534
Energy: 1.0159081500815037
Energy: 0.9852895927003854
Energy: 0.9853607022549395
Energy: 1.0142047646102341
Energy: 1.0618336480617068
Energy: 1.1115662108889208
Energy: 0.9329327277264037
Energy: 0.9854682016512968
Energy: 0.9986621340044872
Energy: 1.083361927448099
Energy: 1.1120651135635522
Energy: 0.9527490720534098
Energy: 1.0842887003358974
Energy: 0.992013353938771
Energy: 1.0555436811202752
Energy: 1.0700046388358286
Energy: 0.9908421759568082
Energy: 1.0784957642447055
Energy: 0.9933711535687457
Energy: 1.059724676769787
Energy: 1.0469493854201137
Energy: 1.019107006421848
Energy: 1.0844989186489977
Energy: 0.9945802036985864
Energy: 1.0852652045253017
Energy: 1.0259516085357339
Energy: 1.0003579545516255
Energy: 1.0869763969398938
Energy: 0.9936384642794753
Energy: 1.08655777037525
Energy: 1.1059257847603798
Energy: 0.9991504484330499
Energy: 1.100156752168823
Energy: 1.0015081877720915
Energy: 1.0611987373046115
Energy: 1.0479226756263307
Energy: 1.1153542538122567
Energy: 1.099543467492709
Energy: 1.0038678251254316
Energy: 1.136268931184889
Energy: 1.094222343574677
Energy: 1.1141960178215704
Energy: 1.0900318202461832
Energy: 1.053259377875238
Energy: 1.0760351414411193
Energy: 1.0934280932275853
Energy: 1.0108185370228044
Energy: 1.095662682424759
Energy: 1.1062049623079504
Energy: 1.0765904724390585
Energy: 1.1373318358200402
Energy: 1.0122735443893245
Energy: 1.0436092204851852
Energy: 1.050014391292279
Energy: 1.0948965861071616
Energy: 1.0787509808652538
Energy: 1.0063716097286874
Energy: 1.0288856767473729
Energy: 1.130404110253761
Energy: 1.0246053757982174
Energy: 1.0790712965280935
Energy: 1.019289824553057
Energy: 1.0960613024468948
Energy: 1.0830601064044258
Energy: 1.0848459338203935
Energy: 1.01134448838932
Energy: 1.1692087443059525
Energy: 0.9966183938899403
Energy: 1.0828951988053377
Energy: 1.0854448913719192
Energy: 1.0136720671304196
Energy: 1.0831778396886205
Energy: 1.0476857415185454
Energy: 1.0702589913419231
Energy: 1.0588838416512756
Energy: 1.0694488308401024
Energy: 1.0494855475423726
Energy: 1.0474866017831472
Energy: 1.0709746513384462
Energy: 1.0613710043511377
Energy: 1.0874457520408265
Energy: 1.0513491030185325
Energy: 1.0668352888592934
Energy: 1.0754343735821825
Energy: 1.067140683708188
Energy: 1.0194843093426587
Energy: 1.0180710647013516
Energy: 1.0662929692507925
Energy: 1.0730177743387808
Energy: 1.0676284004466756
Energy: 1.0091164614027406
Energy: 1.0165486571673559
Energy: 1.0572075799400495
Energy: 1.0747914229858937
Energy: 0.9623791902942305
Energy: 1.137325570409724
Energy: 0.9029802563625087
Energy: 1.0793102113964839
Energy: 1.0694647053082702
Energy: 0.9622018405178557
Energy: 1.143308454368283
Energy: 0.9015437807748854
Energy: 1.0140404723479388
Energy: 1.1487958290431173
Energy: 1.0600737886263705
Energy: 1.0275858421477606
Energy: 1.0974160092517915
Energy: 1.0888113283179932
Energy: 1.075046311797078
Energy: 1.0638031964157622
Energy: 1.014595737000914
Energy: 1.0814039139176925
Energy: 1.0656530759793486
Energy: 1.0941172837726238
Energy: 1.1097970071318675
Energy: 1.0144119020457774
Energy: 1.01273915076741
Energy: 1.0763667822003535
Energy: 1.0929252883470992
Energy: 1.1192735521471338
Energy: 1.013336963815178
Energy: 1.0145067388410924
Energy: 1.0519027796384184
Energy: 1.0115327028832783
Energy: 1.019492861713887
Energy: 1.1124241608026693
Energy: 1.0195212377332439
Energy: 1.088052305501337
Energy: 1.0240352297052198
Energy: 1.0092474801711473
Energy: 1.1120083172734903
Energy: 1.0744277412773915

minimum gb energy = 0.860859218033733 eV
minimum distance =  2.32041593463345 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

Energy: 1.0563437515635739
Energy: 1.000431741590249
Energy: 0.9738321083476189
Energy: 0.9807968926226803
Energy: 0.8511036292521298
Energy: 1.0696727439601663
Energy: 0.8597586155041476
Energy: 0.9750227597015985
Energy: 0.9569417635399324
Energy: 0.850758644869686
Energy: 0.8409780923099102
Energy: 0.9693864040800921
Energy: 0.9601457721756822
Energy: 0.9592575495110984
Energy: 0.9748133041247936
Energy: 1.001557722436629
Energy: 0.9693773699104847
Energy: 0.9834470540987451
Energy: 0.959018296354609
Energy: 0.9709437092016178
Energy: 1.064830037081238
Energy: 0.9571069327671747
Energy: 0.9689874772501297
Energy: 1.1832935094415213
Energy: 1.137882933396758
Energy: 1.065611155052385
Energy: 0.9586162337987548
Energy: 0.9706518462591062
Energy: 1.1646145625389168
Energy: 1.00744544896436
Energy: 1.1196597556576386
Energy: 1.048395612333634
Energy: 1.07175369758319
Energy: 1.0678720040378684
Energy: 0.9736545226688115
Energy: 1.120269566050392
Energy: 1.048767652035125
Energy: 1.0719657851120465
Energy: 1.0685760350549658
Energy: 1.1038131564766285
Energy: 1.0645148152052173
Energy: 1.072840278996145
Energy: 1.0753368381836699
Energy: 1.2006904496996091
Energy: 0.9700187734865602
Energy: 1.0653679232875222
Energy: 1.071915304578393
Energy: 1.074985007676492
Energy: 1.1638669907358994
Energy: 0.9700681316297596
Energy: 0.9582139867429168
Energy: 0.9610917448615014
Energy: 1.1308176543878037
Energy: 1.1265296204903372
Energy: 0.9725981089454262
Energy: 0.9596686630577239
Energy: 0.9715295364871478
Energy: 0.9580127283964703
Energy: 1.1263007073801976
Energy: 0.9710414459360693
Energy: 1.1184188236337662
Energy: 0.9730550455763105
Energy: 0.962760606679697
Energy: 0.9570683474014127
Energy: 1.1205203268682358
Energy: 1.1179136483115388
Energy: 0.973234005054124
Energy: 0.9612538122108489
Energy: 0.9561603309881043
Energy: 1.1216088746188828
Energy: 0.9750901598958065
Energy: 0.9765892840408308
Energy: 0.9650418944552245
Energy: 1.1759613029651594
Energy: 0.9585486395813446
Energy: 0.9606631026433695
Energy: 0.9604447187683606
Energy: 0.9653844173287012
Energy: 1.1746375196302454
Energy: 0.9595780348901588
Energy: 0.97405361220096
Energy: 0.9805664013443878
Energy: 0.9744707332827792
Energy: 0.9568388517818007
Energy: 1.153234346725543
Energy: 1.0059090668203694
Energy: 0.9749256813623639
Energy: 0.9752640988612693
Energy: 0.8610061888072896
Energy: 1.1003013238366706
Energy: 1.1220571107276927
Energy: 0.9742893997804182
Energy: 0.9757393739394418
Energy: 0.9691677617522753
Energy: 0.9789285291416056
Energy: 1.1168876707896074
Energy: 0.9670033143432727
Energy: 0.8562091265906633
Energy: 0.9722132594637525
Energy: 0.9805073490025705
Energy: 0.9997415997439586
Energy: 0.9573076731379495
Energy: 1.069646345392358
Energy: 1.0720154000575324
Energy: 0.8650598454203431
Energy: 0.9990399986849485
Energy: 0.9579520785060051
Energy: 1.070023743191694
Energy: 1.0813378388260348
Energy: 0.8653216250890132
Energy: 1.071864125454418
Energy: 0.9575652715293449
Energy: 0.9699998680794315
Energy: 0.9702549977133622
Energy: 0.9738041709714553
Energy: 1.072549060150244
Energy: 0.9608268376976578
Energy: 0.9686563836210875
Energy: 0.9705025548239716
Energy: 0.9731599255389252
Energy: 0.977247013020879
Energy: 0.9803059561833598
Energy: 0.9818871869314127
Energy: 1.0638767808361909
Energy: 0.9738830383919569
Energy: 0.9710324285714043
Energy: 1.134345378676582
Energy: 0.9592226031125294
Energy: 1.0645489397953634
Energy: 0.973159502799539
Energy: 1.0696162563909544
Energy: 1.0717572230762848
Energy: 1.1375487144961567
Energy: 1.1618015273938829
Energy: 1.0776873014566775
Energy: 1.068692264315082
Energy: 0.9822347259923168
Energy: 1.1480014351218686
Energy: 1.1215017328971901
Energy: 1.0771999037148088
Energy: 1.1431463994683768
Energy: 0.9693307984146311
Energy: 0.9592106858790033
Energy: 1.0642188806419375
Energy: 1.0688887880379445
Energy: 1.1272731513976064
Energy: 0.9695373882745842
Energy: 0.9594275407353754
Energy: 1.0643473726313286
Energy: 1.0514110280440463
Energy: 0.9583416179116941
Energy: 1.1265160471507756
Energy: 0.9696710457948522
Energy: 0.9816668024669324
Energy: 0.9698437042237065
Energy: 0.9612809830455332
Energy: 0.9584879940195354
Energy: 0.970308981147928
Energy: 0.9746832507498415
Energy: 0.9701693435465356
Energy: 0.9604873383000874
Energy: 1.1749829036943125
Energy: 0.8650350512174186
Energy: 1.1178854888916012
Energy: 1.1091775774839794
Energy: 0.9603652385851682
Energy: 1.1776863186820843
Energy: 0.8651701570574482
Energy: 1.1046586355313297
Energy: 1.108868843987987
Energy: 0.9585839227913919
Energy: 1.174337025915036
Energy: 0.9740591509450675
Energy: 1.0038876806279884
Energy: 0.9697317835000626
Energy: 0.8564722324990222
Energy: 1.1551061521286923
Energy: 0.9736209558081933
Energy: 1.0033728395064283
Energy: 0.9679335335179067
Energy: 0.9824357771112501
Energy: 1.0125475582510226
Energy: 1.1383302709722218
Energy: 0.9847420136988665
Energy: 0.9750038253816318
Energy: 0.9838555958569423
Energy: 1.1380891903277561
Energy: 1.1378366033371092
Energy: 0.9842013893944245
Energy: 1.095511600715942
Energy: 0.8391814931867387
Energy: 0.9750656938658501
Energy: 0.9816291492526036
Energy: 0.9717923480686004
Energy: 0.967124919750104
Energy: 0.8588742901277202
Energy: 0.9740722894137988
Energy: 0.9813218475214788
Energy: 0.9727062976065783
Energy: 0.9695851735242863
Energy: 1.046979435855394
Energy: 0.998507181894584
Energy: 1.0359063595903186
Energy: 0.9572945227318308
Energy: 1.0456136919470629
Energy: 1.0725698504840173
Energy: 0.9298200771961378
Energy: 0.9740428248120098
Energy: 0.9580007333646479
Energy: 1.1054758108846245
Energy: 1.0049948804758588
Energy: 0.9701904661418844
Energy: 0.9586069374809607
Energy: 0.9801972451656673
Energy: 0.9710177715040368
Energy: 0.9824603070175815
Energy: 0.9731912580069302
Energy: 0.9594190682909997
Energy: 0.9606377149306907
Energy: 0.9708377163698781
Energy: 1.0641049326108425
Energy: 1.0636014102460052
Energy: 0.9692429316334957
Energy: 1.1259577535419618
Energy: 1.0895565776595344
Energy: 1.0641614645579607
Energy: 0.9595959137797606
Energy: 0.9693670881980645
Energy: 1.1263784391245504
Energy: 1.1034744129518708
Energy: 1.1814383065024154
Energy: 1.074154333951031
Energy: 1.0716807140076108
Energy: 1.067790584956261
Energy: 1.1179739866855438
Energy: 1.1263569717015691
Energy: 1.075317488760929
Energy: 1.0715023355133573
Energy: 1.0685012293684166
Energy: 1.0045604783647841
Energy: 1.0637247851184528
Energy: 1.072656976203301
Energy: 1.048908498933736
Energy: 1.1739656351336087
Energy: 0.974340350089683
Energy: 1.0638131825585064
Energy: 1.0727168485836176
Energy: 1.0520719926568665
Energy: 1.1562926678550662
Energy: 0.9706106987495183
Energy: 0.9701655560266377
Energy: 0.9713165821338916
Energy: 0.9587780301190996
Energy: 1.127552448787916
Energy: 0.9617506305010187
Energy: 0.9705764982179124
Energy: 0.9693885817210478
Energy: 0.9581225286355199
Energy: 1.1279243546875244
Energy: 0.9700666295109476
Energy: 1.1093781448187434
Energy: 0.9737406595017329
Energy: 0.9579751229695256
Energy: 1.1523048547568768
Energy: 0.8653903575365578
Energy: 0.975221331328916
Energy: 0.9739738802844202
Energy: 0.9584477861184054
Energy: 0.9564076462384494
Energy: 0.865412826288132
Energy: 0.9716083456178215
Energy: 1.0032914695321706
Energy: 0.9744109237000723
Energy: 1.1781008014780168
Energy: 0.8626593086762462
Energy: 0.9715891799061175
Energy: 0.9742495643381343
Energy: 0.9774754205383605
Energy: 1.213073925925553
Energy: 0.9741011084655082
Energy: 1.0067444201432099
Energy: 0.9752489084760659
Energy: 0.9741339324365627
Energy: 1.0048997321774953
Energy: 1.180772948415823
Energy: 1.006041180578367
Energy: 0.9744080328773749
Energy: 0.9747625189334964
Energy: 1.0053779719791152
Energy: 1.179663070214428
Energy: 1.1043277788884993
Energy: 0.9697295406648857
Energy: 1.0692452523950904
Energy: 0.8557554614432848
Energy: 0.9770234668493079
Energy: 1.1105567021969784
Energy: 0.9664855904711148
Energy: 1.073973389439046
Energy: 1.071196423697926
Energy: 0.9760665139131899
Energy: 0.9808275039520988
Energy: 0.9586920393685385
Energy: 1.0708382457284258
Energy: 1.0727953798367484
Energy: 0.9636736692307452
Energy: 0.97793214921661
Energy: 0.9595462790924859
Energy: 1.0712671612921714
Energy: 1.0716636196031044
Energy: 1.0340511782112207
Energy: 1.1259059215520817
Energy: 0.9600676039205763
Energy: 0.970813676596482
Energy: 1.0634369057694282
Energy: 0.9701750116197209
Energy: 1.126159397857421
Energy: 0.9575353535029197
Energy: 0.971083271582571
Energy: 0.9589711739957401
Energy: 0.9715630546730009
Energy: 0.9720482191711144
Energy: 1.1334760160603363
Energy: 0.9858387818883273
Energy: 1.064344447134221
Energy: 0.9702536107727185
Energy: 1.0111115530578945
Energy: 1.1335410660814993
Energy: 0.9841445476023352
Energy: 1.064172453003494
Energy: 0.9699032074541926
Energy: 1.0701016816228641
Energy: 1.0631773935363382
Energy: 1.0607580268042172
Energy: 1.1986042368288372
Energy: 1.0120147914843753
Energy: 1.0683315049321374
Energy: 0.9565721350818458
Energy: 1.0603681956622901
Energy: 1.1993298160082522
Energy: 1.0466568274181682
Energy: 1.1270385721293212
Energy: 0.956450348002383
Energy: 0.9585440841196785
Energy: 1.0647903984200613
Energy: 1.07476009743637
Energy: 1.19801869541788
Energy: 0.9560962689986876
Energy: 0.9588806035991503
Energy: 1.0652094748312715
Energy: 1.076831099293506
Energy: 0.9602238827773253
Energy: 1.1271742229065989
Energy: 0.9697137446828156
Energy: 0.9745846832479469
Energy: 0.9710318821632211
Energy: 0.9590132700170912
Energy: 1.1285875525162654
Energy: 0.9696424033880797
Energy: 1.0038235209522182
Energy: 0.9708134518211163
Energy: 0.9577532547479635
Energy: 0.9745906257948663
Energy: 1.0043622219401347
Energy: 0.973855999405313
Energy: 1.1092217938090476
Energy: 0.9571028617779788
Energy: 0.9746206638256781
Energy: 0.9583918644400847
Energy: 0.9712847695929946
Energy: 1.108989885484498
Energy: 0.9743434379554712
Energy: 1.1769737982626725
Energy: 0.975308601535385
Energy: 0.9713400785881185
Energy: 0.9740323227379962
Energy: 0.8560682430596983
Energy: 1.1789783080021188
Energy: 0.9750210535775137
Energy: 0.9707907986613104
Energy: 0.9772425340466679
Energy: 0.9823573176965471
Energy: 1.1573224596485165
Energy: 1.1528513877612088
Energy: 0.9833436678669418
Energy: 0.9743610592371111
Energy: 0.9834784282930664
Energy: 1.158301711324142
Energy: 1.139404646988302
Energy: 0.9851515190824175
Energy: 0.9743709779412761
Energy: 1.0753717923727693
Energy: 0.9582898572901453
Energy: 0.9835332602987821
Energy: 1.1380306679935148
Energy: 0.9657714971240114
Energy: 1.0632651224046787
Energy: 0.960099912199113
Energy: 0.9824281086346777
Energy: 1.1378792121557912
Energy: 1.0684104207693372

minimum gb energy = 0.8391814931867387 eV
minimum distance =  2.31429034157655 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 1.1995109788976437
Energy: 1.0883809346380366
Energy: 1.1681056565273773
Energy: 1.0929778855131322
Energy: 1.088850093243338
Energy: 1.1994391931005695
Energy: 1.0921562706914305
Energy: 1.1686109651942898
Energy: 1.0922745779513918
Energy: 1.0898120981340014
Energy: 1.0888994159345855
Energy: 1.0932506856328534
Energy: 1.0926101815396239
Energy: 1.0923051513714865
Energy: 1.0910572094316944
Energy: 1.169633438005273
Energy: 1.0940107625231057
Energy: 1.089285011220425
Energy: 1.0927936073680855
Energy: 1.091332894308194
Energy: 1.0922129617257628
Energy: 1.0933816246874533
Energy: 1.0920687009938075
Energy: 1.092966652517853
Energy: 1.1698137702303835
Energy: 1.091520856565959
Energy: 1.0929594619783125
Energy: 1.0928554706155
Energy: 1.1693071476850248
Energy: 1.1698162388132385
Energy: 1.1692616830403946
Energy: 1.0895604776033723
Energy: 1.0897596061955326
Energy: 1.0911675398082246
Energy: 1.1699869339535496
Energy: 1.1689106505154054
Energy: 1.0891730022910857
Energy: 1.0892188382619254
Energy: 1.0914116972461778
Energy: 1.1489820700248852
Energy: 1.092200785582968
Energy: 1.0911607674443324
Energy: 1.090364857749975
Energy: 1.093717532442391
Energy: 1.0936959329814766
Energy: 1.0915253357015426
Energy: 1.0919382263930049
Energy: 1.0876996930974718
Energy: 1.0934099065612537
Energy: 1.092820399292968
Energy: 1.0927993867844907
Energy: 1.1693498738860788
Energy: 1.091552238737976
Energy: 1.0946439123320142
Energy: 1.0901963445998608
Energy: 1.093301468502922
Energy: 1.1684395587219893
Energy: 1.0920822073445655
Energy: 1.093245319087978
Energy: 1.0887922827401464
Energy: 1.168049584593404
Energy: 1.1500631445523335
Energy: 1.0912379552697056
Energy: 1.0925897971442684
Energy: 1.0931301360856378
Energy: 1.1682678169195992
Energy: 1.1504858457035303
Energy: 1.0910011326069329
Energy: 1.0926299428376656
Energy: 1.0925658794138198
Energy: 1.091572554919784
Energy: 1.1684943947085904
Energy: 1.0924130973295034
Energy: 1.1994257578197716
Energy: 1.0903803420618499
Energy: 1.0921640696435502
Energy: 1.169626136675642
Energy: 1.0924001040511186
Energy: 1.200197696514902
Energy: 1.0898791444828422
Energy: 1.0938164934765058
Energy: 1.0894914176389536
Energy: 1.0911232466305911
Energy: 1.0907187848956938
Energy: 1.1690432412480687
Energy: 1.0923536634022468
Energy: 1.0922794563970297
Energy: 1.0910869305951734
Energy: 1.0901456648180743
Energy: 1.169403785288664
Energy: 1.0931910867070411
Energy: 1.0921726060808161
Energy: 1.1689236650534098
Energy: 1.1700907964521883
Energy: 1.091601131937908
Energy: 1.1486265274144853
Energy: 1.1480797723076757
Energy: 1.2333862280428178
Energy: 1.0921461174430065
Energy: 1.0939078263552975
Energy: 1.0881279645515127
Energy: 1.0907041897712424
Energy: 1.0898717046445567
Energy: 1.0934583200157977
Energy: 1.1697858854870442
Energy: 1.0901986937631254
Energy: 1.0909644535606755
Energy: 1.1506240479583174
Energy: 1.093214036750908
Energy: 1.1712014806876572
Energy: 1.199754217011056
Energy: 1.0927341097905712
Energy: 1.168055101866472
Energy: 1.0928047959951555
Energy: 1.0886600916522409
Energy: 1.2000871344258768
Energy: 1.0919563952419207
Energy: 1.1690656847239418
Energy: 1.09248775984547
Energy: 1.0895722144604472
Energy: 1.1687255712945492
Energy: 1.0928140524497156
Energy: 1.0926014108215103
Energy: 1.0922824592629028
Energy: 1.0910948450533036
Energy: 1.169610544789489
Energy: 1.093842998689666
Energy: 1.0892584330992867
Energy: 1.092737216048779
Energy: 1.0912177114399935
Energy: 1.0921972454010045
Energy: 1.0938091442702107
Energy: 1.0921796772786014
Energy: 1.0931919340261838
Energy: 1.169944524841005
Energy: 1.0916195141123957
Energy: 1.0931071919655724
Energy: 1.0933452537466772
Energy: 1.169441388643287
Energy: 1.1700106705785192
Energy: 1.1695962883262139
Energy: 1.0890456525034533
Energy: 1.0898404276990192
Energy: 1.0911463033673119
Energy: 1.1699290532238409
Energy: 1.169019397064813
Energy: 1.0895035165242462
Energy: 1.0893598479166229
Energy: 1.0915216050762542
Energy: 1.1700287875243731
Energy: 1.0920584320658786
Energy: 1.0913030382284306
Energy: 1.0891361848019319
Energy: 1.093363241299045
Energy: 1.0936627978553943
Energy: 1.091654964426339
Energy: 1.0913458723728233
Energy: 1.0887806526798312
Energy: 1.093966092539609
Energy: 1.0930909871693504
Energy: 1.0927344752933024
Energy: 1.1691421989042876
Energy: 1.0914157624419867
Energy: 1.0943554275111418
Energy: 1.0901133186482546
Energy: 1.0932103352976894
Energy: 1.1684657971011707
Energy: 1.0920592771234703
Energy: 1.0935410175990843
Energy: 1.0889903001783587
Energy: 1.168604078158419
Energy: 1.149517042158597
Energy: 1.0913537231007369
Energy: 1.0924002462189837
Energy: 1.0931259477681747
Energy: 1.1685569874865556
Energy: 1.150234150230048
Energy: 1.0909892528310443
Energy: 1.0924582386985413
Energy: 1.0933854463546893
Energy: 1.0915201769061766
Energy: 1.1682389266734488
Energy: 1.095111981962433
Energy: 1.1990012529916358
Energy: 1.0910389560667417
Energy: 1.0918790850505482
Energy: 1.1696925532157707
Energy: 1.0922868384673803
Energy: 1.2001289480975368
Energy: 1.0907159234769297
Energy: 1.094160821886632
Energy: 1.0893664543815866
Energy: 1.0911291504571996
Energy: 1.0905112063411773
Energy: 1.1694700218607734
Energy: 1.0924595959644485
Energy: 1.0922484239586892
Energy: 1.0910259035555883
Energy: 1.0901726534127616
Energy: 1.093227772956029
Energy: 1.0937369014329614
Energy: 1.0952582403042823
Energy: 1.1690683008379585
Energy: 1.0922340153303738
Energy: 1.0918439375076499
Energy: 1.148553502472509
Energy: 1.1480732288276017
Energy: 1.2333441656514916
Energy: 1.0923386015950964
Energy: 1.09415591602994
Energy: 1.0879352013175871
Energy: 1.0908984445809615
Energy: 1.0898501184177025
Energy: 1.168581076305526
Energy: 1.170468529133401
Energy: 1.0902000200116155
Energy: 1.090941043772351
Energy: 1.1509186651954753
Energy: 1.168243046822633
Energy: 1.1716465839956238

minimum gb energy = 1.0876996930974718 eV
minimum distance =  2.33928648798521 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.0693599670846303
Energy: 1.0883438216826185
Energy: 1.1732961022335626
Energy: 1.1219375375004437
Energy: 1.0763656756626
Energy: 1.0609508466826414
Energy: 1.0764829432696035
Energy: 1.122406041482658
Energy: 1.1458876315890147
Energy: 1.083297669650973
Energy: 1.0191433806850503
Energy: 1.0784650023634774
Energy: 1.0532262417887812
Energy: 1.0528561999636614
Energy: 1.0867936806424783
Energy: 1.0145300398130443
Energy: 1.0592276517268597
Energy: 1.0527037770162815
Energy: 1.0607161014488096
Energy: 1.042372686780035
Energy: 1.039967716042108
Energy: 1.1051753192517424
Energy: 1.1124318517352803
Energy: 1.120708849946154
Energy: 1.2091711961302405
Energy: 1.0352381517410207
Energy: 1.0671021686520454
Energy: 1.1483292815938124
Energy: 1.122495871164991
Energy: 1.1934078617992314
Energy: 1.120053450324035
Energy: 1.0605816806260429
Energy: 1.0523613815944002
Energy: 1.0631120912816816
Energy: 1.1694789997159354
Energy: 1.1142173838700635
Energy: 1.0584328319247214
Energy: 1.0518750972746684
Energy: 1.0503848808013618
Energy: 1.1776846060865025
Energy: 1.0577220190947876
Energy: 1.0657582198063273
Energy: 1.0729106834158098
Energy: 1.1129390827458252
Energy: 1.2388215201492256
Energy: 1.0655628533071786
Energy: 1.065234356005244
Energy: 1.0656575001015411
Energy: 1.1130458573440887
Energy: 1.2325267128349076
Energy: 1.1531681287055426
Energy: 1.0682297550354931
Energy: 1.0423785079675953
Energy: 1.091963901807495
Energy: 1.053226675897053
Energy: 1.1550934284530245
Energy: 1.056003184432426
Energy: 1.025173266060433
Energy: 1.089174038071399
Energy: 1.23091396104947
Energy: 1.055686051211454
Energy: 1.0540111177133233
Energy: 1.0489775955998937
Energy: 1.0842743285948233
Energy: 1.0542778913091533
Energy: 1.0523007057124218
Energy: 1.0515832121228936
Energy: 1.045486772598875
Energy: 1.0689654236690482
Energy: 1.0356764683557014
Energy: 1.0894338226413498
Energy: 1.0561008854278806
Energy: 1.1013293001874154
Energy: 1.068511751369149
Energy: 1.1072452631758718
Energy: 1.0873370732797816
Energy: 1.0526607080347776
Energy: 1.1037589834537689
Energy: 1.0632434011716487
Energy: 1.1125739410232363
Energy: 1.1008802048817936
Energy: 1.1893715918325143
Energy: 1.1101608410062562
Energy: 1.317582936245188
Energy: 1.0805472258950004
Energy: 1.1022253426018984
Energy: 1.1697539939418318
Energy: 1.1000540986205332
Energy: 1.200180249738914
Energy: 1.0763548090831692
Energy: 1.0984746406738948
Energy: 1.0869686365403994
Energy: 1.0924966493138333
Energy: 1.077747655184931
Energy: 1.0767713095409723
Energy: 1.077783136548742
Energy: 1.0948948569157209
Energy: 1.068427661964659
Energy: 1.0893071938077574
Energy: 1.0744609798629072
Energy: 1.0809032178929945
Energy: 1.0297164962924559
Energy: 1.0831921818369277
Energy: 1.0622158259657855
Energy: 1.0437871472332096
Energy: 1.1192584385118063
Energy: 1.0593519723651694
Energy: 1.07491636306718
Energy: 1.0849084428201914
Energy: 1.0673812001167209
Energy: 1.0416763598190735
Energy: 1.0932323184330757
Energy: 1.1021009114041775
Energy: 1.0478709985407448
Energy: 1.087409578566448
Energy: 1.081761124683816
Energy: 1.0865103008635753
Energy: 1.0297337340470003
Energy: 1.097458182107685
Energy: 1.095253800703873
Energy: 1.128280270961492
Energy: 1.095529630558558
Energy: 1.093649930300138
Energy: 1.0585671399151177
Energy: 1.0820677679568902
Energy: 1.129741385053041
Energy: 1.0855641178165685
Energy: 1.0733865275670835
Energy: 1.06315331091391
Energy: 1.106752153031549
Energy: 1.1343255744976657
Energy: 1.0938872740419823
Energy: 1.0579377335356843
Energy: 1.031728476504102
Energy: 1.070833786472283
Energy: 1.0942327449890608
Energy: 1.0897490259013716
Energy: 1.0536700908858474
Energy: 1.0388301484127018
Energy: 1.068378465621836
Energy: 1.0925088578095639
Energy: 1.1461037123853297
Energy: 1.1797075296685826
Energy: 1.0955245378164766
Energy: 1.009671510366566
Energy: 1.098694036920417
Energy: 1.1478700917470548
Energy: 1.0340064928578525
Energy: 1.091576263529313
Energy: 1.0416316616910914
Energy: 1.1737610707111517
Energy: 1.0356955891515498
Energy: 1.05242427073523
Energy: 1.1108385838922652
Energy: 1.215474871496969
Energy: 1.180159411620287
Energy: 1.036745513875622
Energy: 1.0522637412722573
Energy: 1.129106411058932
Energy: 1.0922520994975622
Energy: 1.062079713510434
Energy: 1.0957245514426024
Energy: 1.2504236366384889
Energy: 1.0974472877097419
Energy: 1.0838645529691526
Energy: 1.0618108585631683
Energy: 1.0252032617930538
Energy: 1.2213717770907266
Energy: 1.0586172738617385
Energy: 1.140328684621055
Energy: 1.06558052730794
Energy: 1.0980768602287507
Energy: 1.0247700486543563
Energy: 1.1375331375120845
Energy: 1.011446793259964
Energy: 1.065021877983213
Energy: 1.0945188212394203
Energy: 1.0259000970540473
Energy: 1.1349814109172711
Energy: 1.0097456323804013
Energy: 1.0564997056435157
Energy: 1.0668338153500192
Energy: 1.0960035735316322
Energy: 1.0479704920881854
Energy: 1.0481519523778842
Energy: 0.9987363781524685
Energy: 1.0852655118870018
Energy: 1.070284379428774
Energy: 1.0466289836145137
Energy: 1.0478777050979105
Energy: 1.082014169223403
Energy: 1.0603181706206872
Energy: 1.1210139973473698
Energy: 1.0556954889405177
Energy: 1.0537619758977772
Energy: 1.0811643186109723
Energy: 1.060447347617614
Energy: 1.0956140548337021
Energy: 1.0594034097170941
Energy: 1.0744136616960958
Energy: 1.1061815379937432
Energy: 1.1240030032089572
Energy: 1.0730247525824006
Energy: 1.0918798594330108
Energy: 1.0798809165742016
Energy: 1.0724681322076604
Energy: 1.1001609832517447
Energy: 1.0837600027073686
Energy: 1.1976600988411277
Energy: 1.1286422041394164
Energy: 1.0673615287675149
Energy: 1.102308048223041
Energy: 1.1151477946860626
Energy: 1.165151291603198
Energy: 1.0869689646107887
Energy: 1.0683689930408553
Energy: 1.0948166008441078
Energy: 1.1152324016293669
Energy: 1.1935000126726831
Energy: 1.1023404125464507
Energy: 1.0466695603432086
Energy: 1.1028765260147428
Energy: 1.1177165558143494
Energy: 1.0202048438004883
Energy: 1.0825204290327748
Energy: 1.0470579001666476
Energy: 1.0683467500113675
Energy: 1.1302716034897413
Energy: 1.043381219203199
Energy: 1.0510815054097098
Energy: 1.0166404173493602
Energy: 1.0977494531320326
Energy: 1.0796899996596565
Energy: 1.0797234282049923
Energy: 1.0797901431982904
Energy: 1.0112173963561124
Energy: 1.110427140330334
Energy: 1.080856715611352
Energy: 1.0893721369468106
Energy: 1.07830228047992
Energy: 1.1099384421921064
Energy: 1.1040676342184281
Energy: 1.0388768654450524
Energy: 1.0993321174895432
Energy: 1.0604574809893461
Energy: 1.0658170454860947
Energy: 1.1028451950813256
Energy: 1.1924220631101436
Energy: 1.0873608531453276
Energy: 1.0888209780996674
Energy: 1.1352997136137182
Energy: 1.0896033965195655
Energy: 1.0533721698770164
Energy: 1.0800122662329523
Energy: 1.1045446920794597
Energy: 1.124158630483292
Energy: 1.0878436152133475
Energy: 1.0789170358143652
Energy: 1.0808168488659011
Energy: 1.0685641878732057
Energy: 1.0185570279767564
Energy: 1.0847648728254955
Energy: 1.0263498264531346
Energy: 1.115969458691221
Energy: 1.210549790835989
Energy: 1.0746678019971567
Energy: 1.0746781061784478
Energy: 1.0144658824608928
Energy: 1.0866564423559293
Energy: 1.2165328075216044
Energy: 1.155464753021462
Energy: 1.0302394426222066
Energy: 1.0676880698175382
Energy: 1.0603065460030945
Energy: 1.2110183784579112
Energy: 1.151434555024073
Energy: 1.0308828735568651
Energy: 1.0522117614178923
Energy: 1.0531006803881482
Energy: 1.2112489693053228
Energy: 1.0580236532816099
Energy: 1.0648601839401872
Energy: 1.0815652618479699
Energy: 1.0999221543481197
Energy: 1.0756845770143735
Energy: 1.089847326972697
Energy: 1.0793301425751423
Energy: 1.0823361968836502
Energy: 1.1001290169696407
Energy: 1.0743850921558142
Energy: 1.1968583836147313
Energy: 1.069189445889248
Energy: 1.041115237164277
Energy: 1.1024982573931326
Energy: 1.0635698695928781
Energy: 1.1940744700888233
Energy: 1.0914635877174783
Energy: 1.0609352904101412
Energy: 1.1007139466106597
Energy: 1.093871430451484
Energy: 1.0448162257748628
Energy: 1.0495080795246
Energy: 1.0425731825051658
Energy: 1.0972743081349194
Energy: 1.2256788474772238
Energy: 1.0435997971874256
Energy: 1.0592436919345685
Energy: 1.0446491321618816
Energy: 1.0727158934491177
Energy: 1.0570776705663927
Energy: 1.085580844199516
Energy: 1.0643231705622143
Energy: 1.0602000511046663
Energy: 1.106246188175366
Energy: 1.075049302715605
Energy: 1.068265718194415
Energy: 1.0502665057972682
Energy: 1.0586638971896594
Energy: 1.062990049702474
Energy: 1.0734084427429365
Energy: 1.0950773067149366
Energy: 1.1808033539564442
Energy: 1.1110875578056938
Energy: 1.0850406395617442
Energy: 1.1097140066785687
Energy: 1.08739132623078
Energy: 1.0548447583045535
Energy: 1.1106084640765763
Energy: 1.1369364737213143
Energy: 1.1180774998659382
Energy: 1.0848655109213312
Energy: 1.072957377333121
Energy: 1.0865716650384256
Energy: 1.0618429038490143
Energy: 1.116086140537104
Energy: 1.0794721366098607
Energy: 1.0792079656020963
Energy: 1.0928445198973302
Energy: 1.0618271087943265
Energy: 1.090738813986205
Energy: 1.1412470196541022
Energy: 1.055163257168807
Energy: 1.0705396981164867
Energy: 1.0499088343360943
Energy: 1.0608163587918302
Energy: 1.1636235425881212
Energy: 1.1180126715882763
Energy: 1.0639001931766205
Energy: 1.0974429391858955
Energy: 1.0767735610403388
Energy: 1.1218720261169552
Energy: 1.0728824551022522
Energy: 1.0712373649853038
Energy: 1.0985994525357057
Energy: 1.086261825137356
Energy: 1.080966460579579
Energy: 1.0602173749066646
Energy: 0.9737791478838258
Energy: 1.0512160217484554
Energy: 1.0793529716792343
Energy: 1.0560216330033698
Energy: 1.055139957801922
Energy: 1.058730219444795
Energy: 1.0580288628497678
Energy: 1.0489200598699961
Energy: 1.1429481508770238
Energy: 1.060251300808965
Energy: 1.0497492454328385
Energy: 1.0852770147164204
Energy: 1.0671424544226547
Energy: 1.1355297774799185
Energy: 1.0778556438956908
Energy: 1.094434058670101
Energy: 1.0653550351364223
Energy: 1.0804308753803398
Energy: 1.1057703913062669
Energy: 1.0809620946893903
Energy: 1.0675220611458198
Energy: 1.0742638603350698
Energy: 1.1137174277893371
Energy: 1.1243360560542053
Energy: 1.1304563337421067
Energy: 1.162885136879588
Energy: 1.0924889840529195
Energy: 1.041443005198266
Energy: 1.1118272110008505
Energy: 1.1126704038060373
Energy: 1.0489837685781795
Energy: 1.11622105244379
Energy: 1.0609148579449794
Energy: 1.172653044688671
Energy: 1.0781569356798546
Energy: 1.0601169109883708
Energy: 1.0381581715709207
Energy: 1.0705140478996145
Energy: 1.1875789806098125
Energy: 1.0843446261883716
Energy: 1.1638682641106832
Energy: 1.0471057870943146
Energy: 1.1346433311461626
Energy: 1.095069856514024
Energy: 1.0661306593181694
Energy: 1.2194284411811023
Energy: 1.1320195849986032
Energy: 1.0651106929290957
Energy: 1.09981689132081
Energy: 1.07853122790333
Energy: 1.1960201526303096
Energy: 1.1324297659052056
Energy: 1.092422838284908
Energy: 1.0666100707083592
Energy: 1.0940865197117158
Energy: 1.1000669655057629
Energy: 1.1681792470052315
Energy: 1.0357794874965969
Energy: 1.0625482850799066
Energy: 1.0990176415715947
Energy: 1.097584833016416
Energy: 1.1706925048302887
Energy: 1.0677843823125426
Energy: 1.0606933903806706
Energy: 1.0466001739276345
Energy: 1.094885203863877
Energy: 1.056476030825751
Energy: 1.0416591458704196
Energy: 1.0460352109693596
Energy: 1.0533334820607645
Energy: 1.0970909049821427
Energy: 1.0636321689516974
Energy: 1.0437201644546692
Energy: 1.0734458673094363
Energy: 1.091249255572965
Energy: 1.0928786621241784
Energy: 1.0585917023948912
Energy: 1.0340490240005187
Energy: 1.0779881903528492
Energy: 1.063064740223863
Energy: 1.0921898849010734
Energy: 1.063549504344215
Energy: 1.0501867223282941
Energy: 1.1001965377875387
Energy: 1.0824949660109906
Energy: 1.0928013580196296
Energy: 1.0772059943507526
Energy: 1.0748054862770078
Energy: 1.0973557279914699
Energy: 1.1049086385129947
Energy: 1.086012457314437
Energy: 1.1229287337329201
Energy: 1.0931344005692425
Energy: 1.0695562704105301
Energy: 1.0598079237054814
Energy: 1.099132320947645
Energy: 1.095630022884448
Energy: 1.0643321236421122
Energy: 1.0796642482525254
Energy: 1.0606931643712216
Energy: 1.0889080765794446
Energy: 1.0876887029845204
Energy: 1.095731636394674
Energy: 1.0499573139669558
Energy: 1.0656663972179055
Energy: 1.0691242051106615
Energy: 1.082808922050603
Energy: 1.0501396223789803
Energy: 1.0345693030422254
Energy: 1.0658852572163062
Energy: 1.05247164997341
Energy: 0.9863019661548322
Energy: 1.0531305766045527
Energy: 1.0398100653680407
Energy: 1.1177083270273864
Energy: 1.0789882923864464
Energy: 1.0501121792406845
Energy: 1.0878835839185539
Energy: 1.014498915452824
Energy: 1.1010529232581687
Energy: 1.08075837866063
Energy: 1.0621475953229154
Energy: 1.075585514189854
Energy: 1.1232518458123084
Energy: 1.0756501908674494
Energy: 1.1508426374531056
Energy: 1.1000004882800858
Energy: 1.0699366202643819
Energy: 1.0684779378034137
Energy: 1.0594951127080316
Energy: 1.1090192647254369
Energy: 1.1130351476858011
Energy: 1.0895689630697765

minimum gb energy = 0.9737791478838258 eV
minimum distance =  2.28113009107766 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.6465540694113134
Energy: 0.97047234849516
Energy: 1.0376569304229963
Energy: 1.0296073784267632
Energy: 0.9090460052350652
Energy: 1.0265869940346264
Energy: 0.9410449023728835
Energy: 1.0382986475307754
Energy: 1.0309734030902975
Energy: 0.909688996932035
Energy: 1.0465472066768327
Energy: 1.017341916044428
Energy: 1.1111658669247977
Energy: 1.0616145485652926
Energy: 1.1032386935333502
Energy: 1.029236089565638
Energy: 1.0717500008431549
Energy: 1.1122629924718892
Energy: 1.0653724120891495
Energy: 1.152217847087193
Energy: 0.9391578113887084
Energy: 0.9887520242801854
Energy: 0.9729817729571715
Energy: 0.9657899548189383
Energy: 1.0844729825012223
Energy: 0.9397553427090013
Energy: 1.06895043314298
Energy: 0.9765824732579117
Energy: 0.9930091101095393
Energy: 1.0810340317063343
Energy: 0.9616461354816058
Energy: 0.9527128473466032
Energy: 0.9445515988347416
Energy: 0.9302793296989037
Energy: 1.0784256929119538
Energy: 0.9498258828095328
Energy: 0.9457336032406921
Energy: 0.9451262307080631
Energy: 0.9609000466737739
Energy: 1.0794522564146964
Energy: 0.959563616608094
Energy: 0.946305771632216
Energy: 0.94323000885177
Energy: 0.9659629745371422
Energy: 0.9148006397249859
Energy: 0.9575953815519024
Energy: 0.9482743723257333
Energy: 0.9439853509225375
Energy: 0.9905952966937567
Energy: 0.9123869830574848
Energy: 0.9408378093238053
Energy: 0.9574747728277838
Energy: 1.0131818720051782
Energy: 0.9394150842431951
Energy: 1.0276250962886613
Energy: 0.9413892781212021
Energy: 0.9585640492847854
Energy: 1.0011210562882167
Energy: 0.9393469629729837
Energy: 1.0273873231552104
Energy: 0.9993442476423944
Energy: 0.9886000009362802
Energy: 1.018131465553128
Energy: 1.0507463442719092
Energy: 1.026743378237466
Energy: 0.996936790274884
Energy: 0.9907767336612274
Energy: 0.9925703988825767
Energy: 1.0264506269803004
Energy: 0.9727046178738066
Energy: 1.0683148503156847
Energy: 0.9712289646349043
Energy: 0.9592480572281278
Energy: 1.1277224198809748
Energy: 1.1707269793356987
Energy: 0.9809274350057733
Energy: 1.0278897119318415
Energy: 0.9594869784312487
Energy: 1.0419235365400756
Energy: 1.171673313622558
Energy: 0.9484082876897421
Energy: 1.0458991926607104
Energy: 0.9406173056801307
Energy: 0.9729548261138543
Energy: 0.9724040912354407
Energy: 0.9498245925936217
Energy: 1.0467422115982474
Energy: 0.9783983438992464
Energy: 1.2254349881434279
Energy: 0.9465162362104962
Energy: 0.9341969024679665
Energy: 1.1296951307563259
Energy: 0.958993672218393
Energy: 1.2168188222407224
Energy: 0.9440683329889167
Energy: 0.9213759165378425
Energy: 1.093395184838633
Energy: 0.958524557775137
Energy: 1.2141343905690898
Energy: 0.9443970133098458
Energy: 0.9601237605025501
Energy: 0.9423950201011679
Energy: 0.9147853662664231
Energy: 1.0269468434497668
Energy: 0.9537256935477954
Energy: 0.9614278149237654
Energy: 0.9431865843535999
Energy: 0.946794133853809
Energy: 0.9725698581083944
Energy: 0.9598398711362692
Energy: 0.9420857031822051
Energy: 0.9442875222769861
Energy: 0.9308440937063983
Energy: 0.985485458051867
Energy: 0.9285847408221088
Energy: 0.9428277252141236
Energy: 0.9443715654814575
Energy: 1.094680926138803
Energy: 0.9940313380411722
Energy: 0.9267781463841734
Energy: 0.9437481610313175
Energy: 0.9595766421118637
Energy: 1.019942306719612
Energy: 1.0191345481965657
Energy: 0.9971587448308513
Energy: 0.9438454748310946
Energy: 0.958676842029387
Energy: 1.0460659614970955
Energy: 1.1698357483118975
Energy: 0.9556694682827921
Energy: 1.0107402859137282
Energy: 0.9483941287041066
Energy: 0.9989523547777721
Energy: 0.9482735875742262
Energy: 0.9370354622582989
Energy: 1.0571911362054338
Energy: 0.9472143230697192
Energy: 1.0576252456236963
Energy: 0.9466515023324621
Energy: 0.9389939657814192

minimum gb energy = 0.9090460052350652 eV
minimum distance =  2.3265257847487 Angstroms
sigma value = 33